SCHEMBL9813433

SCHEMBL9813433

CC(C)c1ccc(N)cc1-c1ccc(-c2cc(N)ccc2C(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.44
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
ALDH1A1 P00352 6/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
TP53 P04637 3/20 0.38
CYP3A4 P08684 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
PTPRC P08575 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
APAF1 O14727 1/20 0.36
TDP2 O95551 1/20 0.36
NSD2 O96028 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
SCHEMBL30792432 1.00 ANPEP (0.44) ANPEPCA1CA2CA12CA9
SCHEMBL9034484 0.91 USP7 (0.43) ANPEPCA1CA2CA12CA9
SCHEMBL14744110 0.90 ANPEP (0.44) ANPEPCA1CA2CA12CA9
SCHEMBL30792455 0.86 ANPEP (0.47) ANPEPCA1CA2ALDH1A1NPC1
SCHEMBL9813442 0.86 ANPEP (0.47) ANPEPCA1CA2ALDH1A1NPC1
SCHEMBL3654907 0.86 ALDH1A1 (0.44) ANPEPCA1CA2CA12CA9
SCHEMBL10518876 0.83 APP (0.42) ANPEPCA1CA2CA12CA9
SCHEMBL29640954 0.83 ALDH1A1 (0.42) ANPEPCA1CA2CA12CA9
SCHEMBL5394134 0.81 ANPEP (0.42) ANPEPCA1CA2CA12CA9
Methane SCHEMBL28181127 0.79 ANPEP (0.41) ANPEPCA1CA2CA12CA9

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
EP-0320238-B1 IMIDE TYPE PREPOLYMER COMPOSITIONS AND PROCESSES FOR PREPARING SAME MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-07-03 EP claimed