SCHEMBL7985253

SCHEMBL7985253

Nc1ccc(C2CCN(C(=O)O)CC2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.41
OPRL1 P41146 1/20 0.41
MAOA P21397 1/20 0.39
RBP4 P02753 3/20 0.39
CCR2 P41597 2/20 0.38
NPC1 O15118 1/20 0.38
SLC9A1 P19634 3/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
CRBN Q96SW2 1/20 0.36
ADRA1D P25100 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A3 Q01959 1/20 0.36
SLC9A2 Q9UBY0 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
GFER P55789 1/20 0.36

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
SCHEMBL31140149 1.00 PARP10 (0.41) PARP10OPRL1MAOARBP4CCR2
SCHEMBL3816206 0.88 RBP4 (0.39) PARP10OPRL1RBP4CCR2NPC1
SCHEMBL25429337 0.84 SLC9A1 (0.40) PARP10OPRL1RBP4CCR2NPC1
SCHEMBL23291680 0.82 KDM1A (0.43) PARP10OPRL1RBP4NPC1ALDH1A1
SCHEMBL15524740 0.82 OPRL1 (0.41) OPRL1NPC1SLC9A1CRBNADRA1D
SCHEMBL24753454 0.82 DRD4 (0.46) OPRL1MAOARBP4CHRM4
SCHEMBL3989140 0.81 RBP4 (0.37) PARP10MAOARBP4NPC1SLC9A1
SCHEMBL6395680 0.80 GPR119 (0.56) NPC1ALDH1A1MAPTMAPK1
SCHEMBL29535803 0.80 GPR119 (0.56) NPC1ALDH1A1MAPTMAPK1
SCHEMBL16825003 0.80 RBP4 (0.35) RBP4CCR2SLC9A1CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4192458-A1 COMPOUNDS FOR TARGETED DEGRADATION OF RET C4 Therapeutics, Inc. (US) 2023-06-14 EP disclosed
WO-2022270994-A1 NOVEL BIFUNCTIONAL HETEROCYCLIC COMPOUND HAVING BTK DEGRADATION FUNCTION VIA UBIQUITIN PROTEASOME PATHWAY, AND USE THEREOF 한국화학연구원 2022-12-29 WO disclosed
EP-3752491-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Nuvation Bio Inc. (US) 2020-12-23 EP disclosed
WO-2019161224-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS GiraFpharma LLC (US) 2019-08-22 WO disclosed
US-9266864-B2 VEGFR3 inhibitors CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2016-02-23 US disclosed
US-20150225377-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2015-08-13 US disclosed
US-20140080798-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-03-20 US disclosed
US-6313307-B1 DEBLOCKING, DEPROTECTING; CATALYTIC HYDROGENATION, ALKYLATION; PREPARING MICROBIOCIDES AGAINST STAPHYLOCOCCUS, STREPTOCOCCUS, MYCOBACTERIUM, AND CLOSTRIDIUM PHARMACIA & UPJOHN COMPANY 2001-11-06 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-20150225377-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR PARP10 2261/4885OPRL1 1495/4885MAOA 3301/4885
US-20140080798-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR PARP10 2339/4885OPRL1 3004/4885MAOA 3260/4885

“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.