SCHEMBL11450859

SCHEMBL11450859

CC(CN(N)CC(C)OC(=O)Nc1ccccc1)OC(=O)Nc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 4/20 0.46
▸ MAPT P10636 2/20 0.45
▸ CASP3 P42574 2/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ LMNA P02545 3/20 0.43
▸ DRD4 P21917 1/20 0.43
▸ SLC6A2 P23975 1/20 0.43
▸ CCKAR P32238 1/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ SCN1A P35498 1/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ HTR2B P41595 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ SCN2A Q99250 1/20 0.43

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
SCHEMBL10639437 0.81 RAB9A (0.50) MAPTCASP3RAB9AMEN1KMT2A
SCHEMBL10912953 0.80 CTSK (0.52) MAPTCASP3RAB9AMEN1KMT2A
SCHEMBL17342587 0.80 ALDH1A1 (0.48) MAPTCASP3RAB9AMEN1KMT2A
SCHEMBL4843503 0.78 MAPT (0.50) MAPTCASP3RAB9AMEN1KMT2A
SCHEMBL21201035 0.78 L3MBTL1 (0.51) MAPTCASP3RAB9AMEN1KMT2A
Propham SCHEMBL67344 0.77 SMN1; SMN2 (0.66) MAPTCASP3RAB9AMEN1KMT2A
Propham SCHEMBL8536412 0.77 SMN1; SMN2 (0.66) MAPTCASP3RAB9AMEN1KMT2A
SCHEMBL5696634 0.76 RAB9A (0.57) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL17346769 0.76 MAPT (0.58) MAPTCASP3RAB9AMEN1KMT2A
Propham SCHEMBL2231188 0.76 SMN1; SMN2 (0.60) GRM5MAPTRAB9AMEN1KMT2A

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-0006693-A1 N-substituted trialkylstannylhydrocarbylcarboxylic acid hydrazides, methods of their preparation and insecticide compositions containing them UNIROYAL, INC. (US) 1980-01-09 — — EP claimed
Send feedback