SCHEMBL27848320

SCHEMBL27848320

Cc1ccc(-c2ncc(-c3nc4ccccc4o3)n2-c2ccc(F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.43
▸ RAB9A P51151 7/20 0.43
▸ KDM4E B2RXH2 6/20 0.41
▸ SMN1; SMN2 Q16637 6/20 0.41
▸ ALDH1A1 P00352 6/20 0.41
▸ HPGD P15428 5/20 0.41
▸ TP53 P04637 4/20 0.41
▸ HSD17B10 Q99714 4/20 0.41
▸ PTPN2 P17706 2/20 0.41
▸ PTPN1 P18031 2/20 0.41
▸ PTPN5 P54829 2/20 0.41
▸ HSPD1 P10809 1/20 0.41
▸ HSPE1 P61604 1/20 0.41
▸ GRIA1 P42261 1/20 0.40
▸ CACNG8 Q8WXS5 1/20 0.40
▸ CACNG2 Q9Y698 1/20 0.40
▸ PIK3CD O00329 2/20 0.40
▸ PIK3CA P42336 2/20 0.40
▸ CASP3 P42574 2/20 0.40
▸ SENP8 Q96LD8 2/20 0.40

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
SCHEMBL27848308 0.81 ALDH1A1 (0.52) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL27848407 0.81 NPC1 (0.48) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL27848305 0.77 NPC1 (0.44) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL12103547 0.76 NPC1 (0.56) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL27848485 0.75 PTPN2 (0.40) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL27848319 0.74 MEN1 (0.48) NPC1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL27865377 0.74 PTPN2 (0.42) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL27865414 0.74 MET (0.43) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL27865341 0.73 NPC1 (0.44) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL28794160 0.72 P2RY14 (0.43) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1

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
CN-102428080-A Therapeutic or prophylactic agent for diseases in which neurotrophic factor activity participates SUMITOMO CHEMICAL CO 2012-04-25 — — CN disclosed
Send feedback