SCHEMBL17199972

SCHEMBL17199972

COC(=O)c1c(Cl)c2ccccc2n1-c1ccc(CN)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 10/20 0.46
▸ LOXL2 Q9Y4K0 2/20 0.44
▸ MAPK9 P45984 4/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ F10 P00742 2/20 0.40
▸ PLA2G2A P14555 1/20 0.39
▸ MAPK10 P53779 1/20 0.39
▸ CCR2 P41597 1/20 0.39
▸ PTPN1 P18031 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
Hydrochloric Acid SCHEMBL2732706 0.99 MAPK8 (0.45) MAPK8LOXL2MAPK9HDAC6KDM4E
SCHEMBL2730661 0.88 GAA (0.47) HDAC6ALDH1A1HPGDMAPK10
SCHEMBL27928721 0.85 MAPK8 (0.46) MAPK8LOXL2MAPK9HDAC6KDM4E
SCHEMBL2730314 0.85 CCR2 (0.41) MAPK8MAPK9HDAC6F10PLA2G2A
Hydrochloric Acid SCHEMBL2731134 0.84 CCR2 (0.41) MAPK8MAPK9HDAC6ALDH1A1F10
SCHEMBL2731042 0.82 LOXL2 (0.42) MAPK8LOXL2MAPK9ALDH1A1MAPK10
SCHEMBL2730596 0.82 MAPK8 (0.39) MAPK8MAPK9HDAC6KDM4EALDH1A1
SCHEMBL2731177 0.81 MAPK8 (0.44) MAPK8MAPK9KDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL2730594 0.81 MAPK8 (0.39) MAPK8MAPK9HDAC6KDM4EALDH1A1
SCHEMBL2730493 0.79 MAPK8 (0.42) MAPK8MAPK9KDM4EALDH1A1HPGD

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-2635567-B1 INDOLE DERIVATIVES RICHTER GEDEON NYRT (HU) 2015-10-28 — — EP disclosed
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