SCHEMBL6462984

SCHEMBL6462984

N#Cc1c(N)nc(Sc2ccccc2)c(C#N)c1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
KDM4E B2RXH2 4/20 0.59
NPSR1 Q6W5P4 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
RET P07949 3/20 0.52
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
ALOX15 P16050 2/20 0.50
LMNA P02545 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ADORA1 P30542 9/20 0.49
ALDH1A1 P00352 3/20 0.48
HPGD P15428 2/20 0.48
HIF1A Q16665 2/20 0.48
GALR3 O60755 1/20 0.48
MAPK14 Q16539 1/20 0.46
ADORA2A P29274 5/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL15286440 0.87 L3MBTL1 (0.53) MAPTKDM4ENPSR1RXFP1RET
SCHEMBL245593 0.86 ADORA1 (0.64) MAPTKDM4ENPSR1RXFP1RET
SCHEMBL244863 0.82 ADORA1 (0.61) MAPTKDM4ENPSR1RXFP1RET
SCHEMBL13938147 0.82 ADORA1 (0.62) MAPTKDM4ENPSR1RXFP1RET
SCHEMBL245478 0.82 ADORA1 (0.65) MAPTKDM4ENPSR1RXFP1RET
SCHEMBL28185531 0.81 KDM4E (0.73) MAPTKDM4ENPSR1RXFP1RET
SCHEMBL3546986 0.81 ADORA1 (0.58) MAPTKDM4ENPSR1RXFP1RET
SCHEMBL4024351 0.81 ADORA1 (0.66) MAPTKDM4ENPSR1RXFP1MEN1
SCHEMBL15286658 0.80 ADORA1 (0.64) MAPTKDM4ENPSR1RXFP1RET
SCHEMBL3333404 0.80 MAPT (0.81) MAPTKDM4ENPSR1RXFP1RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050182105-A1 Method of using 3-cyano-4-arylpyridine derivatives as modulators of androgen receptor function BRISTOL-MYERS SQUIBB COMPANY 2005-08-18 US claimed
US-20050182105-A1 Method of using 3-cyano-4-arylpyridine derivatives as modulators of androgen receptor function BRISTOL-MYERS SQUIBB COMPANY 2005-08-18 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-20050182105-A1 Method of using 3-cyano-4-arylpyridine derivatives as modulators of androgen receptor function NR3C2, NR4A3, NR3C1 MAPT 4827/4885KDM4E 1261/4885NPSR1 179/4885

“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.