SCHEMBL11706148

SCHEMBL11706148

CC(C(=O)NO)c1ccc(C(=O)c2cccs2)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
ALDH1A1 P00352 5/20 0.46
CYP2C9 P11712 3/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
APOBEC3A P31941 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
HDAC1 Q13547 2/20 0.41
CHRM1 P11229 1/20 0.41
PDE4A P27815 1/20 0.41
MAPT P10636 5/20 0.40
ALOX15 P16050 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
SCHEMBL11703609 0.86 SMN1; SMN2 (0.46) HPGDALDH1A1CYP2C9LMNAKDM4E
Cliprofen SCHEMBL11702737 0.86 PTGS1 (0.63) HPGDALDH1A1CYP2C9LMNAKDM4E
Cliprofen SCHEMBL42298 0.86 PTGS1 (0.63) HPGDALDH1A1CYP2C9LMNAKDM4E
Cliprofen SCHEMBL29910028 0.86 PTGS1 (0.63) HPGDALDH1A1CYP2C9LMNAKDM4E
SCHEMBL11707677 0.85 HPGD (0.42) HPGDALDH1A1CYP2C9LMNAKDM4E
SCHEMBL11707683 0.85 HPGD (0.42) HPGDALDH1A1CYP2C9LMNAKDM4E
SCHEMBL11702059 0.81 HPGD (0.50) HPGDALDH1A1CYP2C9LMNAKDM4E
SCHEMBL11706345 0.80 KMT2A (0.57) ALDH1A1LMNAKDM4ESMN1; SMN2NPC1
SCHEMBL11706354 0.80 KMT2A (0.57) ALDH1A1LMNAKDM4ESMN1; SMN2NPC1
SCHEMBL11703606 0.79 HPGD (0.72) HPGDALDH1A1CYP2C9LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4064132-A ANTIINFLAMMATORY AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1977-12-20 US disclosed
US-4060528-A ANTIINFLAMMATORY JANSSEN PHARMACEUTICA N.V. (BE) 1977-11-29 US disclosed
US-4035376-A ESTERS, AMIDES, HYDROXAMIC ACIDS, ANTIINFLAMMATORY JANSSEN PHARMACEUTICA N.V. (BE) 1977-07-12 US disclosed