SCHEMBL3935246

SCHEMBL3935246

O=C(CCl)Nc1cc(CSc2ncccc2C(=O)Nc2ccc(OC(F)F)cc2)ccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.52
KMT2A Q03164 6/20 0.39
GRM4 Q14833 1/20 0.39
ENPP1 P22413 1/20 0.38
LMNA P02545 4/20 0.38
MAPT P10636 3/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
PKM P14618 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
KDM4E B2RXH2 2/20 0.38
HTT P42858 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 2/20 0.37
GAA P10253 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL1940970 0.92 KDR (0.51) KDRKMT2AGRM4ENPP1LMNA
SCHEMBL1943519 0.92 KDR (0.50) KDRKMT2AGRM4ENPP1LMNA
SCHEMBL1939750 0.90 KDR (0.47) KDRKMT2AGRM4ENPP1LMNA
SCHEMBL1941605 0.89 KDR (0.48) KDRKMT2ALMNAMAPTCRHBP
SCHEMBL3932852 0.89 KDR (0.48) KDRKMT2AMAPTCRHBPCRHR2
SCHEMBL1940688 0.89 KDR (0.47) KDRKMT2ALMNAMAPTCRHBP
SCHEMBL3926500 0.88 KDR (0.52) KDRKMT2AMAPTCRHBPCRHR2
SCHEMBL1940559 0.88 KDR (0.50) KDRKMT2ALMNAMAPTCRHBP
SCHEMBL1941021 0.87 KDR (0.44) KDRKMT2ALMNAMAPTCRHBP
SCHEMBL1940989 0.87 KDR (0.44) KDRKMT2ALMNAMAPTCRHBP

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-7544703-B2 Cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 US disclosed
US-20070149574-A1 Novel cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein SANTEN PHARMACEUTICAL CO., LTD. (JP) 2007-06-28 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-20070149574-A1 Novel cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein FLT4, FLT1, TIE1 KDR 12/4885KMT2A 2966/4885GRM4 2081/4885

“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.