SCHEMBL6288927

SCHEMBL6288927

Cc1ccc(-c2c(OCCOc3ccc(F)cc3)nn(C)c2N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.45
DRD2 P14416 2/20 0.43
DRD3 P35462 2/20 0.43
DRD4 P21917 1/20 0.43
SRC P12931 2/20 0.41
BRAF P15056 2/20 0.41
KDR P35968 2/20 0.41
DRD1 P21728 1/20 0.39
DRD5 P21918 1/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 2/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HPGD P15428 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
SCHEMBL6289615 0.88 MAPT (0.48) DRD2DRD3DRD4NPC1RAB9A
SCHEMBL6288971 0.83 MAPT (0.41) MAPK14SRCBRAFKDRNPC1
SCHEMBL6292692 0.81 MAPT (0.39) MAPK14RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL6292817 0.78 LMNA (0.37) MAPK14RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL6361331 0.76 FABP4 (0.43) MAPTTSHRL3MBTL1
SCHEMBL8053251 0.73 DRD2 (0.70) DRD2DRD3DRD4DRD1DRD5
SCHEMBL1719539 0.71 MAPT (0.69) MAPK14SRCBRAFKDRNPC1
SCHEMBL21711400 0.67 MAPK14 (0.56) MAPK14SRCBRAFKDRSMN1; SMN2
SCHEMBL21185868 0.66 DRD2 (0.57) DRD2DRD3DRD4NPC1HPGD
SCHEMBL13860530 0.66 MAPT (0.57) NPC1RAB9ASMN1; SMN2LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6962923-B2 Pyrazole compositions PFIZER INC. (US) 2005-11-08 US disclosed
US-20030232848-A1 Pyrazole compositions PFIZER INC. 2003-12-18 US disclosed
US-6573270-B1 Endothelin receptor antagonists PFIZER INC. 2003-06-03 US disclosed
EP-1072597-A1 Pyrazoles and their use as endothelin antagonists Pfizer Limited (GB) 2001-01-31 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 (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-20030232848-A1 Pyrazole compositions EDNRB, EDNRA, AGTR1 MAPK14 1816/4885DRD2 849/4885DRD3 371/4885

“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.