SCHEMBL6923337

SCHEMBL6923337

O=C(Nc1ccccc1C[PH](=O)O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.59
RAB9A P51151 3/20 0.59
PLAU P00749 1/20 0.49
CASP3 P42574 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
TP53 P04637 2/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
ATM Q13315 1/20 0.48
MAOB P27338 3/20 0.47
MGLL Q99685 1/20 0.47
PTPN1 P18031 1/20 0.46
KDM1A O60341 2/20 0.45
MAOA P21397 2/20 0.45
ENPP2 Q13822 1/20 0.44
LMNA P02545 1/20 0.44
ROCK2 O75116 1/20 0.44
RCOR1 Q9UKL0 1/20 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
SCHEMBL9741137 0.86 NPC1 (0.57) NPC1RAB9APLAUCASP3POLB
SCHEMBL9588889 0.82 NPC1 (0.70) NPC1RAB9APLAUCASP3POLB
SCHEMBL15516309 0.82 NPC1 (0.66) NPC1RAB9APLAUCASP3POLB
SCHEMBL2559038 0.82 NPC1 (0.61) NPC1RAB9APLAUCASP3POLB
SCHEMBL4291027 0.81 NPC1 (0.64) NPC1RAB9APLAUCASP3POLB
SCHEMBL1163050 0.81 NPC1 (0.64) NPC1RAB9APLAUCASP3POLB
SCHEMBL8705480 0.79 NPC1 (0.61) NPC1RAB9APLAUCASP3POLB
SCHEMBL6978902 0.78 NPC1 (0.60) NPC1RAB9APLAUCASP3POLB
SCHEMBL3081379 0.77 RAB9A (0.66) NPC1RAB9APLAUCASP3POLB
SCHEMBL8894000 0.77 NPC1 (0.58) NPC1RAB9APLAUCASP3POLB

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
US-6518260-B1 (α-aminophosphino) peptide derivatives, method for making same and therapeutic applications thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2003-02-11 US disclosed
US-6391866-B1 ANALGESICS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2002-05-21 US disclosed