SCHEMBL2637845

SCHEMBL2637845

[c]1nn[nH]c1-c1ccco1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.43
PDPK1 O15530 1/20 0.43
KDM4E B2RXH2 8/20 0.42
ALDH1A1 P00352 6/20 0.42
MAPT P10636 6/20 0.42
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
HSD17B10 Q99714 5/20 0.42
POLB P06746 4/20 0.42
HPGD P15428 4/20 0.42
TDP1 Q9NUW8 3/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
PKM P14618 3/20 0.42
ALOX15 P16050 3/20 0.42
BLM P54132 3/20 0.42
CASP1 P29466 2/20 0.42
PTPN7 P35236 2/20 0.42
RECQL P46063 2/20 0.42
CASP7 P55210 2/20 0.42

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
SCHEMBL558390 0.67 RAB9A (0.38) KDM4EALDH1A1POLBHPGDNPC1
SCHEMBL4004334 0.65 CHRM1 (0.33) NPC1RAB9A
SCHEMBL11381307 0.65 HPGDS (0.33)
SCHEMBL1799678 0.65 ALDH1A1 (0.63) PDE10APDPK1KDM4EALDH1A1MAPT
SCHEMBL1036366 0.64 ALDH1A1 (0.45) PDE10AKDM4EALDH1A1MAPTMEN1
SCHEMBL569614 0.63 PDE10A (0.45) PDE10APDPK1KDM4EALDH1A1MAPT
SCHEMBL5954221 0.63 POLB (0.48) PDE10APDPK1KDM4EALDH1A1MAPT
SCHEMBL4110063 0.63 KDM4E (0.31) KDM4E
SCHEMBL19662062 0.62 TAAR1 (0.58) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL8629567 0.61 POLB (0.47) PDE10APDPK1KDM4EALDH1A1MAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2569301-A1 INDAZOLE INHIBITORS OF KINASE Abbvie Inc. (US) 2013-03-20 EP claimed
WO-2011143430-A1 INDAZOLE INHIBITORS OF KINASE ABBOTT LABORATORIES (US) 2011-11-17 WO claimed
EP-4081299-A1 DIHYDRO-CYCLOPENTA-ISOQUINOLINE DERIVATIVES UCB Biopharma SRL (BE) 2022-11-02 EP disclosed
WO-2021130255-A1 DIHYDRO-CYCLOPENTA-ISOQUINOLINE DERIVATIVES UCB Biopharma SRL (BE) 2021-07-01 WO disclosed
EP-2569301-A1 INDAZOLE INHIBITORS OF KINASE Abbvie Inc. (US) 2013-03-20 EP disclosed
WO-2011143430-A1 INDAZOLE INHIBITORS OF KINASE ABBOTT LABORATORIES (US) 2011-11-17 WO disclosed