SCHEMBL10500960

SCHEMBL10500960

NC(=O)C(Cc1ccccc1)(C(N)=O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.59
HIF1A Q16665 1/20 0.59
SLC6A2 P23975 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
ARG1 P05089 1/20 0.42
ARG2 P78540 1/20 0.42
PLA2G10 O15496 1/20 0.42
PLA2G2A P14555 1/20 0.42
FDPS P14324 1/20 0.42
CYP1A2 P05177 3/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CES1 P23141 2/20 0.41
CES2 O00748 1/20 0.41
AKR1B1 P15121 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP3A4 P08684 1/20 0.40
RECQL P46063 1/20 0.40
EPHX1 P07099 1/20 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
SCHEMBL31147812 0.96 SMN1; SMN2 (0.59) SMN1; SMN2HIF1ASLC6A2TAAR1ARG1
SCHEMBL3077561 0.78 HIF1A (0.57) SMN1; SMN2HIF1ASLC6A2TAAR1PLA2G10
SCHEMBL2107223 0.78 SMN1; SMN2 (0.57) SMN1; SMN2HIF1ASLC6A2TAAR1PLA2G10
SCHEMBL28989978 0.78 SMN1; SMN2 (0.52) SMN1; SMN2HIF1ASLC6A2FDPSCYP1A2
SCHEMBL16781446 0.78 SMN1; SMN2 (0.57) SMN1; SMN2HIF1ASLC6A2TAAR1ARG1
SCHEMBL9736276 0.78 SMN1; SMN2 (0.57) SMN1; SMN2HIF1ASLC6A2TAAR1ARG1
SCHEMBL27409870 0.78 SMN1; SMN2 (0.52) SMN1; SMN2HIF1ASLC6A2FDPSCYP1A2
SCHEMBL10483829 0.77 HIF1A (0.55) SMN1; SMN2HIF1ASLC6A2TAAR1ARG1
SCHEMBL8759 0.77 SLC6A2 (0.56) SMN1; SMN2HIF1ASLC6A2TAAR1PLA2G10
SCHEMBL28125890 0.77 HIF1A (0.55) SMN1; SMN2HIF1ASLC6A2TAAR1ARG1

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
US-4835312-A Production process of N-substituted amide compounds MITSUI CHEMICALS, INCORPORATED (JP) 1989-05-30 US disclosed