SCHEMBL11577803

SCHEMBL11577803

C[C]1Cc2ccccc2N1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.56
▸ MAPT P10636 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ AHR P35869 1/20 0.56
▸ PDK2 Q15119 1/20 0.56
▸ HSP90AA1 P07900 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ HK1 P19367 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ RECQL P46063 1/20 0.56
▸ GALK1 P51570 1/20 0.56
▸ BLM P54132 1/20 0.56
▸ HKDC1 Q2TB90 1/20 0.56
▸ ALOX15 P16050 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ BRD4 O60885 2/20 0.44
▸ CREBBP Q92793 2/20 0.44

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
Acridan SCHEMBL29405807 0.79 MAPT (0.65) NPC1MAPTRAB9AKDM4EMEN1
Acridan SCHEMBL183367 0.79 MAPT (0.65) NPC1MAPTRAB9AKDM4EMEN1
Acridan SCHEMBL29446489 0.79 MAPT (0.65) NPC1MAPTRAB9AKDM4EMEN1
Acridan SCHEMBL20594012 0.79 MAPT (0.65) NPC1MAPTRAB9AKDM4EMEN1
SCHEMBL8549657 0.79 NPC1 (0.57) NPC1MAPTRAB9AKDM4EMEN1
SCHEMBL22292641 0.77 NPC1 (0.52) NPC1MAPTRAB9AKDM4EMEN1
SCHEMBL4571016 0.77 MAPT (0.62) NPC1MAPTRAB9AKDM4EMEN1
Acridan SCHEMBL15412652 0.77 MAPT (0.62) NPC1MAPTRAB9AKDM4EMEN1
Acridan SCHEMBL10813635 0.77 MAPT (0.62) NPC1MAPTRAB9AKDM4EMEN1
Acridan SCHEMBL29020974 0.77 MAPT (0.62) NPC1MAPTRAB9AKDM4EMEN1

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
US-4115413-A ACID FREE BAYER AKTIENGESELLSCHAFT (DE) 1978-09-19 — — US claimed
Send feedback