SCHEMBL10576367

SCHEMBL10576367

CC(NC(=O)Nc1ccc2c(c1)oc1c([N+](=O)[O-])cccc12)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.48
HSD17B10 Q99714 1/20 0.47
GPR35 Q9HC97 1/20 0.46
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
GAA P10253 1/20 0.44
C5 P01031 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
MAPK1 P28482 2/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
AVPR1A P37288 1/20 0.41

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
SCHEMBL10575135 1.00 MTOR (0.48) MTORHSD17B10GPR35MEN1KMT2A
SCHEMBL10571131 0.88 IDH1 (0.47) GPR35MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL10571137 0.88 IDH1 (0.47) GPR35MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL10573045 0.79 MTOR (0.54) MTORHSD17B10MEN1KMT2ARAB9A
SCHEMBL10573042 0.79 MTOR (0.54) MTORHSD17B10MEN1KMT2ARAB9A
SCHEMBL10571484 0.74 HSD17B10 (0.51) MTORHSD17B10MEN1KMT2ASMN1; SMN2
SCHEMBL10571478 0.74 HSD17B10 (0.51) MTORHSD17B10MEN1KMT2ASMN1; SMN2
SCHEMBL10574168 0.73 HSD17B10 (0.53) MTORHSD17B10MEN1KMT2ARAB9A
SCHEMBL10574178 0.73 HSD17B10 (0.53) MTORHSD17B10MEN1KMT2ARAB9A
SCHEMBL30135426 0.72 HSD17B10 (0.57) MTORHSD17B10MEN1KMT2ARAB9A

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-4818899-A DIRECTING LASER RADIATION ONTO A N-ARYL CARBAMYL COMPOUND MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-04-04 US disclosed
EP-0271251-A1 Second harmonic generation by carbamic acid derivatives MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-06-15 EP disclosed