SCHEMBL7039260

SCHEMBL7039260

CC1=CC(C)(C)Nc2cc3nc(Cl)cc(C(F)(F)F)c3cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 14/20 1.00
PGR P06401 10/20 0.56
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL7039674 0.86 AR (1.00) ARPGRKDM4EALDH1A1MAPT
SCHEMBL6651156 0.81 AR (0.69) ARPGRKDM4EALDH1A1MAPT
SCHEMBL7023064 0.79 AR (0.67) ARPGRKDM4EALDH1A1MAPT
SCHEMBL7032936 0.75 AR (1.00) ARPGR
SCHEMBL15290656 0.71 PGR (1.00) ARPGRKDM4EALDH1A1MAPT
SCHEMBL7038715 0.71 AR (1.00) ARPGR
SCHEMBL2856726 0.69 AR (0.91) ARPGR
SCHEMBL12476236 0.66 KDM4E (0.51) ARPGRKDM4EALDH1A1MAPT
SCHEMBL27943851 0.66 AR (0.48) ARKDM4EALDH1A1MAPTLMNA
SCHEMBL7073759 0.64 KDM4E (1.00) ARPGRKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030149268-A1 8-substituted-6-trifluoromethyl-9-pyrido[3,2-g]quinoline compounds as androgen receptor modulators HAMANN LAWRENCE G (US) 2003-08-07 US claimed
US-6667313-B1 High affinity and specificity LIGAND PHARMACEUTICALS INC. 2003-12-23 US disclosed
US-20030149268-A1 8-substituted-6-trifluoromethyl-9-pyrido[3,2-g]quinoline compounds as androgen receptor modulators HAMANN LAWRENCE G (US) 2003-08-07 US disclosed
EP-1212322-A2 8-SUBSTITUTED-6-TRIFLUOROMETHYL-9-PYRIDO[3,2-G]QUINOLINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS LIGAND PHARMACEUTICALS INCORPORATED (US) 2002-06-12 EP disclosed
WO-2001016133-A2 8-SUBSTITUTED-6-TRIFLUOROMETHYL-9-PYRIDO[3,2-G]QUINOLINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS LIGAND PHARMACEUTICALS INCORPORATED (US) 2001-03-08 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 (1 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-20030149268-A1 8-substituted-6-trifluoromethyl-9-pyrido[3,2-g]quinoline compounds as androgen receptor modulators AR, SHBG, NR5A1 AR 1/4885PGR 32/4885KDM4E 1493/4885

“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.