SCHEMBL21760985

SCHEMBL21760985

CCOC(=O)Cc1nn2cc(C)nc2s1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.64
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
PKM P14618 2/20 0.64
HTT P42858 1/20 0.64
F2RL3 Q96RI0 3/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 1/20 0.44
TRPM8 Q7Z2W7 1/20 0.42
TP53 P04637 4/20 0.41
POLB P06746 3/20 0.40
NPC1 O15118 1/20 0.40
ALOX15 P16050 1/20 0.40
RECQL P46063 1/20 0.40
RAB9A P51151 1/20 0.40
USP2 O75604 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL21760987 0.76 ALDH1A1 (0.41) MAPTMEN1KMT2APKMHTT
SCHEMBL2431619 0.75 MEN1 (0.45) MAPTMEN1KMT2APKMHTT
SCHEMBL21138063 0.73 TP53 (0.65) MAPTPKMSMN1; SMN2TP53NPC1
SCHEMBL15349939 0.72 TP53 (0.50) MAPTKMT2APKMF2RL3SMN1; SMN2
SCHEMBL21761027 0.72 OPRM1 (0.39) MAPTMEN1KMT2APKMHTT
SCHEMBL21761014 0.71 MEN1 (0.37) MAPTMEN1KMT2APKMHTT
SCHEMBL12210699 0.71 MEN1 (0.48) MAPTMEN1KMT2APKMHTT
SCHEMBL16742697 0.70 MEN1 (0.40) MAPTMEN1KMT2APKMHTT
SCHEMBL696137 0.70 MEN1 (0.51) MAPTMEN1KMT2APKMHTT
SCHEMBL2658210 0.68 PKM (0.51) MAPTMEN1KMT2APKMHTT

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
EP-3842439-A1 BICYCLIC HETEROAROMATIC RING DERIVATIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2021-06-30 EP disclosed
WO-2020040104-A1 BICYCLIC HETEROAROMATIC RING DERIVATIVE 杏林製薬株式会社 2020-02-27 WO disclosed