SCHEMBL19158707

SCHEMBL19158707

Oc1nc(Cc2ccccc2F)nc2cnccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 2/20 0.40
▸ F3 P13726 2/20 0.40
▸ F10 P00742 1/20 0.40
▸ ADORA2A P29274 1/20 0.39
▸ ADORA2B P29275 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ LATS1 O95835 1/20 0.38
▸ HTR6 P50406 1/20 0.38
▸ CXCR2 P25025 1/20 0.37
▸ DHODH Q02127 1/20 0.37
▸ HTR2C P28335 1/20 0.36
▸ HTR2B P41595 1/20 0.36
▸ ROCK2 O75116 2/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ HTT P42858 1/20 0.35

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
SCHEMBL19158131 0.84 F7 (0.40) F7F3F10ADORA2AADORA2B
SCHEMBL16095220 0.78 SGMS2 (0.40) F7F3F10LATS1CXCR2
SCHEMBL19158957 0.74 CXCR2 (0.44) F7F3F10ADORA2AADORA1
SCHEMBL26711507 0.73 KDM4C (0.43) LATS1KDM4E
SCHEMBL16095989 0.71 CXCR2 (0.42) F7F3F10LATS1CXCR2
SCHEMBL17503670 0.70 MAPK1 (0.42) F7F3F10LATS1DHODH
SCHEMBL17503690 0.70 KDM4C (0.46) F7F3F10ADORA2AADORA2B
SCHEMBL19158367 0.70 LATS1 (0.39) LATS1KDM4E
SCHEMBL19158877 0.69 KDM4C (0.40) LATS1KDM4E
SCHEMBL17615668 0.69 KDM4C (0.47) ADRB2MEN1KMT2A

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-2970211-B1 HISTONE DEMETHYLASE INHIBITORS QUANTICEL PHARMACEUTICALS INC (US) 2017-07-26 — — EP disclosed
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