SCHEMBL533230

SCHEMBL533230

Fc1[c]ccc(-c2ccc(F)cc2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.35
BAD Q92934 1/20 0.35
PGR P06401 1/20 0.35
AGXT P21549 1/20 0.35
MAP4K4 O95819 1/20 0.34
TNKS2 Q9H2K2 1/20 0.33
MAOB P27338 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
ESR2 Q92731 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
HTR1A P08908 1/20 0.33
HTR7 P34969 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
ERCC1 P07992 1/20 0.32
ERCC4 Q92889 1/20 0.32
MAPT P10636 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL7861005 0.88
SCHEMBL27338776 0.84 ALOX5 (0.40) BCL2L1TAAR1ESR2MAPTNPC1
SCHEMBL546983 0.84
SCHEMBL1491004 0.83 ALDH1A1 (0.39) CA12CA9CYP11B1CYP11B2MAPT
SCHEMBL6017910 0.83 MCL1 (0.39) MAOBCA12CA9MAPTPDK2
SCHEMBL433164 0.83 ALOX5 (0.42) MAOBMAPTNPC1RAB9APDK2
SCHEMBL694723 0.82 ALDH1A1 (0.41) TAAR1ESR2MAPTNPC1
SCHEMBL144207 0.79 KIF11 (0.47) AGXTMAOBCA12CA9
SCHEMBL15287375 0.78 CA12 (0.34) BCL2L1BADPGRAGXTMAP4K4
SCHEMBL15287395 0.78 PGR (0.33) BCL2L1BADPGRAGXTMAP4K4

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220389009-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GFB (ABC), LLC 2022-12-08 US claimed
CN-114761000-A Substituted 1, 6-naphthyridine inhibitors of CDK5 金翅雀生物公司 2022-07-15 CN claimed
WO-2022011274-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2022-01-13 WO claimed
WO-2021067569-A1 SUBSTITUTED 1, 6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2021-04-08 WO claimed
US-20220389009-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GFB (ABC), LLC 2022-12-08 US disclosed
CN-114761000-A Substituted 1, 6-naphthyridine inhibitors of CDK5 金翅雀生物公司 2022-07-15 CN disclosed
WO-2022011274-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2022-01-13 WO disclosed
WO-2021067569-A1 SUBSTITUTED 1, 6-NAPHTHYRIDINE INHIBITORS OF CDK5 GOLDFINCH BIO, INC. (US) 2021-04-08 WO disclosed
US-9023844-B2 Heterocyclylpyri (mi) dinylpyrazole as fungicidals BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-05-05 US disclosed
US-20140256677-A1 HETEROCYCLYLPYRI (MI) DINYLPYRAZOLE AS FUNGICIDALS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-09-11 US disclosed
EP-2415763-A1 PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA Ube Industries, Ltd. (JP) 2012-02-08 EP disclosed
CN-101437403-A Treatment methods using triaryl methane compounds ICAGEN INC (US) 2009-05-20 CN disclosed
CN-1193748-C Gardos channel antagonists ICAGEN INC (US) 2005-03-23 CN disclosed
CN-1344158-A Gardos channel antagonists ICAGEN INC (US) 2002-04-10 CN disclosed
CN-1305462-A 1,5 and 3-O-substituted 1H-indazoles with antiasthmatic, antiallergic, antiinflammatory, immunomodulating and neuroprotective action, process for their preparation and their use as medicaments DRESDEN ARZNEIMITTEL (DE) 2001-07-25 CN disclosed
US-5057529-A Fungicides SHELL RESEARCH LIMITED (GB) 1991-10-15 US disclosed
CN-86108538-A The inhibition of 5-lipoxygenase pathway 1987-07-29 CN disclosed
US-4530922-A Fungicidal imidazoles and triazoles containing silicon E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-07-23 US 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 (2 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-20140256677-A1 HETEROCYCLYLPYRI (MI) DINYLPYRAZOLE AS FUNGICIDALS CCNY, NQO2, H1-0 BCL2L1 2491/4885BAD 1896/4885PGR 2810/4885
US-20220389009-A1 SUBSTITUTED 1,6-NAPHTHYRIDINE INHIBITORS OF CDK5 CDK5, CDK5R1, PKD1 BCL2L1 638/4885BAD 1838/4885PGR 3514/4885

“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.