SCHEMBL2987993

SCHEMBL2987993

NC(=O)c1cc(C(F)(F)F)ncc1Br

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
DGAT1 O75907 1/20 0.36
PARP1 P09874 5/20 0.36
CA2 P00918 1/20 0.35
CHKA P35790 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
TSHR P16473 1/20 0.35
MC4R P32245 1/20 0.35
ADRA1A P35348 1/20 0.35
MC3R P41968 1/20 0.35
SYK P43405 2/20 0.35
MAPK8 P45983 1/20 0.34
MAPK10 P53779 1/20 0.34
CDC7 O00311 1/20 0.34
ASPH Q12797 1/20 0.33
CASP1 P29466 1/20 0.33
HSP90AA1 P07900 1/20 0.33
AURKA O14965 1/20 0.33
AURKB Q96GD4 1/20 0.33
GPR52 Q9Y2T5 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29664135 1.00 KMT2A (0.38) KMT2ADGAT1PARP1CA2CHKA
SCHEMBL2990846 0.84 ASPH (0.45) CA2TSHRASPH
SCHEMBL30018797 0.84 ASPH (0.45) CA2TSHRASPH
SCHEMBL31696427 0.81 KDM4E (0.41) KMT2ADGAT1PARP1CA2CHKA
SCHEMBL28850941 0.80 POLB (0.34) KMT2A
SCHEMBL22542502 0.79 CASP1 (0.42) KMT2ACA2CASP1
SCHEMBL26337674 0.79 NNMT (0.42) KMT2APARP1CA2CHKASYK
SCHEMBL17293016 0.79 SOS1 (0.47) TSHR
Nitrous Acid SCHEMBL28850943 0.79 ASPH (0.41) CA2TSHRASPH
SCHEMBL30824163 0.79 SOS1 (0.47) TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250282792-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. 2025-09-11 US disclosed
US-20250034162-A1 IMIDAZOPYRIMIDINES AS EED INHIBITORS AND THE USE THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2025-01-30 US disclosed
US-12145944-B2 Imidazopyrimidines as EED inhibitors and the use thereof REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-11-19 US disclosed
CN-118745185-A Imidazopyrimidines as EED inhibitors and use thereof 密歇根大学董事会 2024-10-08 CN disclosed
US-20240316051-A1 A PHARMACEUTICAL COMBINATION AND USE THEREOF ASCENTAGE PHARMA GROUP CORP LIMITED (CN) 2024-09-26 US disclosed
CN-115212311-B Pharmaceutical composition and application thereof 苏州亚盛药业有限公司 2024-08-09 CN disclosed
CN-114127073-B Imidazopyrimidines as EED inhibitors and use thereof 密歇根大学董事会 2024-05-31 CN disclosed
US-11713324-B2 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2023-08-01 US disclosed
CN-116157397-A Heterocyclylpyridines as novel fungicides 拜耳公司 2023-05-23 CN disclosed
CN-115212311-A Pharmaceutical composition and application thereof 苏州亚盛药业有限公司 2022-10-21 CN disclosed
US-8481738-B2 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2013-07-09 US disclosed
US-20130040975-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2013-02-14 US disclosed
US-8263588-B2 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2012-09-11 US disclosed
US-20120122891-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2012-05-17 US disclosed
US-8084614-B2 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2011-12-27 US disclosed
US-20100184741-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. 2010-07-22 US disclosed
US-20100152207-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. 2010-06-17 US disclosed
EP-2155194-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2010-02-24 EP disclosed
WO-2008124610-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2008-10-16 WO disclosed
WO-2008124614-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2008-10-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120122891-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO GNRHR, GHRHR, LHCGR KMT2A 1468/4885DGAT1 2928/4885PARP1 4395/4885
US-20240316051-A1 A PHARMACEUTICAL COMBINATION AND USE THEREOF EED, EML4, KIT KMT2A 368/4885DGAT1 4503/4885PARP1 2604/4885
US-12145944-B2 Imidazopyrimidines as EED inhibitors and the use thereof EED, EEF1D, EEF1A1 KMT2A 1376/4885DGAT1 4214/4885PARP1 2060/4885
US-20250282792-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO GNRHR, GHRHR, LHCGR KMT2A 1468/4885DGAT1 2928/4885PARP1 4395/4885
US-11713324-B2 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto GNRHR, GHRHR, LHCGR KMT2A 1468/4885DGAT1 2928/4885PARP1 4395/4885
US-20130040975-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO GNRHR, GHRHR, LHCGR KMT2A 1562/4885DGAT1 2786/4885PARP1 4442/4885
US-20250034162-A1 IMIDAZOPYRIMIDINES AS EED INHIBITORS AND THE USE THEREOF EED, EEF1D, EEF1A1 KMT2A 1376/4885DGAT1 4214/4885PARP1 2060/4885
US-20100184741-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO GNRHR, GHRHR, LHCGR KMT2A 1562/4885DGAT1 2786/4885PARP1 4442/4885
US-20100152207-A1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO GNRHR, GHRHR, LHCGR KMT2A 1484/4885DGAT1 2901/4885PARP1 4400/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.