SCHEMBL3924375

SCHEMBL3924375

CN1CCC(N(C)CC(=O)NC(Sc2ncccc2C(=O)Nc2ccc(OC(F)(F)F)cc2)c2ccncc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KDR P35968 5/20 0.44
KMT2A Q03164 3/20 0.43
MAPT P10636 2/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
FLT1 P17948 4/20 0.39
MEN1 O00255 1/20 0.38
ATM Q13315 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
P2RY1 P47900 3/20 0.37
PKM P14618 1/20 0.37
ABL1 P00519 4/20 0.37
KCNH2 Q12809 2/20 0.37
EPHX2 P34913 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
SCHEMBL3924786 0.89 KMT2A (0.39) KDRKMT2AFLT1KDM4EALDH1A1
SCHEMBL1940549 0.87 KDR (0.51) L3MBTL1KDRKMT2AMAPTCRHBP
SCHEMBL1942972 0.86 KMT2A (0.53) KDRKMT2AMAPTCRHBPCRHR2
SCHEMBL1941922 0.85 KDR (0.48) L3MBTL1KDRKMT2AMAPTCRHBP
SCHEMBL3928287 0.84 KDR (0.50) L3MBTL1KDRKMT2AMAPTCRHBP
SCHEMBL3933632 0.83 MAPT (0.49) KDRKMT2AMAPTCRHBPCRHR2
SCHEMBL3924396 0.82 KDR (0.47) KDRKMT2AMAPTCRHBPCRHR2
SCHEMBL1940215 0.82 KDR (0.54) L3MBTL1KDRKMT2AMAPTCRHBP
SCHEMBL3926720 0.82 KDR (0.48) L3MBTL1KDRKMT2AMAPTCRHBP
SCHEMBL1939660 0.82 KDR (0.48) L3MBTL1KDRKMT2AMAPTCRHBP

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 TDP1 4444/4885L3MBTL1 2780/4885KDR 12/4885

“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.