SCHEMBL9930223

SCHEMBL9930223

Nc1cc(-c2ccccc2)c(Cl)cn1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.51
SRC P12931 2/20 0.51
MAP4K4 O95819 1/20 0.47
ASIC3 Q9UHC3 1/20 0.44
PDPK1 O15530 1/20 0.44
ALOX5AP P20292 2/20 0.44
FEN1 P39748 2/20 0.44
CYP2A6 P11509 1/20 0.43
ADORA1 P30542 2/20 0.43
CDK9 P50750 2/20 0.41
ADORA2A P29274 2/20 0.41
CSNK2A1 P68400 1/20 0.41
USP7 Q93009 1/20 0.40
TDO2 P48775 1/20 0.40
SMARCA2 P51531 1/20 0.40
SMARCA4 P51532 1/20 0.40
PBRM1 Q86U86 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL1462979 0.82 CYP2A6 (0.49) CYP2A6ADORA2ATDO2
SCHEMBL9929901 0.81 CDK9 (0.57) FGFR1SRCMAP4K4ALOX5APFEN1
SCHEMBL30919693 0.80 CYP2A6 (0.46) FGFR1SRCMAP4K4CYP2A6ADORA1
SCHEMBL23277179 0.80 CYP2A6 (0.46) FGFR1SRCMAP4K4CYP2A6ADORA1
SCHEMBL4733656 0.77 FGFR1 (0.51) FGFR1SRCMAP4K4ASIC3PDPK1
SCHEMBL21290224 0.77 MAP4K4 (0.47) MAP4K4CYP2A6USP7TDO2SMARCA2
SCHEMBL21290181 0.77 MAP4K4 (0.47) MAP4K4CYP2A6ADORA1USP7
SCHEMBL21419499 0.77 ALOX5AP (0.43) FGFR1SRCPDPK1ALOX5APFEN1
SCHEMBL21223874 0.74 FGFR1 (0.49) FGFR1SRCMAP4K4ASIC3PDPK1
SCHEMBL9930222 0.74 CNR2 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157433-A1 Heteroaryl Compounds as Kinase Inhibitors PFISTER KEITH B (US) 2012-06-21 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 (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-20120157433-A1 Heteroaryl Compounds as Kinase Inhibitors CDK2, CDK1, CDK6 FGFR1 464/4885SRC 334/4885MAP4K4 86/4885

“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.