SCHEMBL17611157

SCHEMBL17611157

c1ccc(N2CCSCC2c2nc3cnccc3[nH]2)nc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ DRD4 P21917 5/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ PRCP P42785 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ METAP2 P50579 1/20 0.32
▸ METAP1 P53582 1/20 0.32
▸ HTR2B P41595 3/20 0.32
▸ DPP4 P27487 1/20 0.31
▸ PLD1 Q13393 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31

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
SCHEMBL16053273 0.82 PLD1 (0.39) MAPTRAB9ADRD4DRD2PRCP
SCHEMBL16053223 0.81 NUDT1 (0.38) MAPTRAB9ADRD4DRD2PRCP
SCHEMBL16053274 0.69 MAPT (0.76) MAPTRAB9ADRD4DRD2KDM4E
SCHEMBL16053272 0.62 HTR3A (0.41) MAPTRAB9ADRD4METAP2METAP1
SCHEMBL15767650 0.61 NPC1 (0.48) MAPTRAB9AKDM4EALDH1A1HTR2B
SCHEMBL11397558 0.60 METAP2 (0.77) MAPTRAB9AKDM4EMETAP2METAP1
SCHEMBL14447536 0.59 PARP1 (0.46) MAPTRAB9AKDM4EHTR2B
SCHEMBL7014462 0.58 PLD1 (0.61) MAPTRAB9AKDM4EALDH1A1CYP3A4
SCHEMBL30863815 0.58 PLD1 (0.49) MAPTKDM4EALDH1A1CYP3A4HTR2B
SCHEMBL18124187 0.58 ALDH1A1 (0.57) MAPTKDM4EALDH1A1CYP3A4

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-3194388-A1 IMIDAZO[4,5-C]PYRIDINE DERIVED SSAO INHIBITORS Proximagen Limited (GB) 2017-07-26 — — EP disclosed
WO-2016042331-A1 IMIDAZO[4,5-C]PYRIDINE DERIVED SSAO INHIBITORS PROXIMAGEN LIMITED (GB) 2016-03-24 — — WO disclosed
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