SCHEMBL3603150

SCHEMBL3603150

Cc1cc2c(F)ccc(C#N)c2o1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.39
CYP11B2 P19099 5/20 0.39
TRPV4 Q9HBA0 1/20 0.38
AR P10275 3/20 0.35
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
PGR P06401 3/20 0.33
EGLN2 Q96KS0 2/20 0.33
EGFR P00533 1/20 0.33
KDR P35968 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
APOBEC3G Q9HC16 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
SCHEMBL3605156 0.73 ALDH1A1 (0.35) EGFRKDRALDH1A1KDM4EHPGD
SCHEMBL20562110 0.70 KDM4E (0.44) ESR1ESR2EGFRKDRALDH1A1
SCHEMBL7917308 0.70 IMPDH2 (0.51) ARESR1ESR2EGFRKDR
SCHEMBL3603406 0.69 TRPV4 (0.37) CYP11B1CYP11B2TRPV4AREGLN2
SCHEMBL29559045 0.69 NSD2 (0.34) ARPGRALDH1A1KDM4EMAPT
SCHEMBL26756454 0.68 ALDH1A1 (0.37) EGFRKDRALDH1A1KDM4EHPGD
SCHEMBL21951039 0.68 ALDH1A1 (0.37) ALDH1A1KDM4EMAPTHPGD
SCHEMBL22434878 0.68 TRPV4 (0.37) CYP11B1CYP11B2TRPV4ARESR1
SCHEMBL8486966 0.68 KCNH2 (0.34) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL8486719 0.67 AR (0.41) ARALDH1A1KDM4EMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250100981-A1 Cis-substituted 5-(hydroxymethyl)morpholine-2-carboxamides as agonists of SSTR4 BOEHRINGER INGELHEIM INT (DE) 2025-03-27 US disclosed
WO-2025027049-A1 (2S,5R)-5-(HYDROXYMETHYL)MORPHOLINE-2-CARBOXAMIDES AS AGONISTS OF SSTR4 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2025-02-06 WO disclosed
EP-1553074-B1 FUSED BENZENE DERIVATIVE AND USE TAKEDA PHARMACEUTICAL (JP) 2014-06-18 EP disclosed
US-7649001-B2 Fused benzene derivative and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-19 US disclosed
US-20060106067-A1 Fused benzene derivative and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-05-18 US disclosed
EP-1553074-A1 FUSED BENZENE DERIVATIVE AND USE Takeda Pharmaceutical Company Limited (JP) 2005-07-13 EP 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-20060106067-A1 Fused benzene derivative and use AR, NR5A1, CBR3 CYP11B1 24/4885CYP11B2 16/4885TRPV4 958/4885
US-20250100981-A1 Cis-substituted 5-(hydroxymethyl)morpholine-2-carboxamides as agonists of SSTR4 SSTR4, SSTR5, SSTR2 CYP11B1 816/4885CYP11B2 499/4885TRPV4 250/4885

“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.