SCHEMBL7911678

SCHEMBL7911678

Cc1cccc(-c2ccc(C)nc2C(=O)O)n1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.50
CCR8 P51685 1/20 0.50
TGFBR1 P36897 12/20 0.44
GRM5 P41594 2/20 0.42
CYP2A6 P11509 1/20 0.41
RAB9A P51151 1/20 0.40
TGFBR2 P37173 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL30775055 0.82 KDM4E (0.48) GRM5RAB9AKDM4EALDH1A1HPGD
SCHEMBL3385678 0.82 KDM4E (0.48) GRM5RAB9AKDM4EALDH1A1HPGD
SCHEMBL2473544 0.81 DHODH (0.40) CCR1CCR8TGFBR1GRM5CYP2A6
SCHEMBL2473782 0.79 KMO (0.38) TGFBR1RAB9AKDM4E
SCHEMBL610009 0.79 PIN1 (0.49) KDM4EALDH1A1
SCHEMBL29077608 0.78 CCR1 (0.44) CCR1CCR8TGFBR1CYP2A6RAB9A
SCHEMBL19207150 0.76 TGFBR1 (0.47) CCR1CCR8TGFBR1TGFBR2KDM4E
SCHEMBL264270 0.76 HCRTR2 (0.50) KDM4EALDH1A1
SCHEMBL30775045 0.76 HCRTR2 (0.50) KDM4EALDH1A1
SCHEMBL6609571 0.76 ALDH1A1 (0.58) CCR1CCR8TGFBR1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100144760-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-06-10 US disclosed
US-20100144760-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-06-10 US disclosed
WO-2010063663-A1 N-{[(IR,4S,6R-3-(2-PYRIDINYLCARBONYL)-3-AZABICYCLO [4.1.0]HEPT-4-YL] METHYL}-2-HETEROARYLAMINE DERIVATIVES AND USES THEREOF GLAXO GROUP LIMITED (GB) 2010-06-10 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-20100144760-A1 NOVEL COMPOUNDS HTR3B, HTR1B, HTR2B CCR1 3456/4885CCR8 2661/4885TGFBR1 4264/4885

“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.