SCHEMBL14435680

SCHEMBL14435680

BCc1ccc(NC(=O)C(C)NC)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.48
BIRC2 Q13490 1/20 0.48
MAPT P10636 3/20 0.45
SPHK1 Q9NYA1 4/20 0.43
CRHBP P24387 2/20 0.42
CRHR2 Q13324 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.41
KMT2A Q03164 4/20 0.41
KLK7 P49862 1/20 0.40
MEN1 O00255 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 1/20 0.40
RXFP1 Q9HBX9 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
SCHEMBL21350543 0.85 CRHBP (0.55) XIAPBIRC2MAPTSPHK1CRHBP
SCHEMBL21533085 0.83 PLG (0.51) XIAPBIRC2MAPTSPHK1SMN1; SMN2
SCHEMBL22593900 0.83 MAPT (0.60) XIAPBIRC2MAPTCRHBPCRHR2
SCHEMBL24086454 0.83 MAPT (0.60) XIAPBIRC2MAPTCRHBPCRHR2
SCHEMBL25007557 0.81 CIT (0.50) MAPTSPHK1CRHBPCRHR2SMN1; SMN2
SCHEMBL14446974 0.81 CIT (0.50) MAPTSPHK1CRHBPCRHR2SMN1; SMN2
SCHEMBL21229646 0.81 SMN1; SMN2 (0.47) XIAPBIRC2MAPTSPHK1CRHBP
SCHEMBL20150736 0.80 MAPT (0.67) XIAPBIRC2MAPTSMN1; SMN2NPC1
SCHEMBL24496737 0.80 CRHBP (0.46) XIAPBIRC2MAPTSPHK1CRHBP
SCHEMBL22854190 0.80 SPHK1 (0.63) SPHK1SMN1; SMN2GAANPC1RAB9A

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-7262164-B2 Polymeric thiol-linked prodrugs employing benzyl elimination systems ENZON, INC. (US) 2007-08-28 US disclosed
US-7262164-B2 Polymeric thiol-linked prodrugs employing benzyl elimination systems ENZON, INC. (US) 2007-08-28 US disclosed