SCHEMBL9188352

SCHEMBL9188352

O=C(CF)NNc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.61
RAB9A P51151 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
NPC1 O15118 3/20 0.57
ALDH1A1 P00352 4/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
RECQL P46063 1/20 0.55
CTSV O60911 1/20 0.54
CTSL P07711 1/20 0.54
NR4A1 P22736 1/20 0.54
NR4A2 P43354 1/20 0.54
NR4A3 Q92570 1/20 0.54
LMNA P02545 1/20 0.54
GAA P10253 1/20 0.54
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
PTPN1 P18031 1/20 0.52
PTPN6 P29350 1/20 0.52
PTPN11 Q06124 1/20 0.52

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
SCHEMBL4667938 0.82 LTA4H (0.64) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL8402761 0.81 LTA4H (0.56) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL9188849 0.81 ALOX5 (0.61) SMN1; SMN2ALDH1A1LMNAGAACYP1A2
Bromide SCHEMBL7915837 0.80 LTA4H (0.54) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL27764698 0.79 MEN1 (0.67) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL9192465 0.76 PTGS2 (0.55) RAB9ASMN1; SMN2NPC1ALDH1A1LMNA
SCHEMBL4666205 0.76 RAB9A (0.74) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL21067416 0.76 LTA4H (1.00) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL4113161 0.75 NR4A2 (0.70) RAB9ASMN1; SMN2NPC1ALDH1A1NR4A1
SCHEMBL21295527 0.75 MEN1 (0.77) LTA4HRAB9ASMN1; SMN2NPC1ALDH1A1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596983-B1 MONO- AND DIFLUOROACETYLPHENYL HYDRAZINE COMPOUNDS AS SILVER HALIDE ADJUVANTS DU PONT (US) 1995-11-02 EP claimed
EP-0596983-A1 MONO- AND DIFLUOROACETYLPHENYL HYDRAZINE COMPOUNDS AS SILVER HALIDE ADJUVANTS. DU PONT (US) 1994-05-18 EP claimed
US-5252426-A Lithogrpahic film coated with silver halide emulsions can produce high contrast images E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-10-12 US claimed
WO-1993003414-A1 MONO- AND DIFLUOROACETYLPHENYL HYDRAZINE COMPOUNDS AS SILVER HALIDE ADJUVANTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-02-18 WO claimed
EP-0596983-B1 MONO- AND DIFLUOROACETYLPHENYL HYDRAZINE COMPOUNDS AS SILVER HALIDE ADJUVANTS DU PONT (US) 1995-11-02 EP disclosed
EP-0596983-A1 MONO- AND DIFLUOROACETYLPHENYL HYDRAZINE COMPOUNDS AS SILVER HALIDE ADJUVANTS. DU PONT (US) 1994-05-18 EP disclosed
US-5252426-A Lithogrpahic film coated with silver halide emulsions can produce high contrast images E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-10-12 US disclosed
WO-1993003414-A1 MONO- AND DIFLUOROACETYLPHENYL HYDRAZINE COMPOUNDS AS SILVER HALIDE ADJUVANTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-02-18 WO disclosed