SCHEMBL9142109

SCHEMBL9142109

CCCCNC(=O)c1cccc(S(=O)(=O)NC(=O)c2ccc(C(=O)OC(C)C)nc2)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
P4HTM Q9NXG6 6/20 0.47
FBP1 P09467 1/20 0.44
EGLN1 Q9GZT9 1/20 0.42
KMT2A Q03164 3/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
PAX8 Q06710 1/20 0.40
CASP3 P42574 1/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL9137873 0.96 P4HTM (0.45) SMN1; SMN2P4HTMFBP1EGLN1KMT2A
SCHEMBL9141271 0.93 SMN1; SMN2 (0.49) SMN1; SMN2P4HTMFBP1KMT2ABCL2L1
SCHEMBL9139411 0.91 RAB9A (0.45) SMN1; SMN2P4HTMFBP1KMT2AMEN1
SCHEMBL9139358 0.91 P4HTM (0.50) SMN1; SMN2P4HTMBCL2L1MCL1CASP3
SCHEMBL9138985 0.90 SMN1; SMN2 (0.46) SMN1; SMN2P4HTMFBP1KMT2ABCL2L1
SCHEMBL9139745 0.90 P4HTM (0.47) P4HTMKMT2AMEN1HPGDCASP3
SCHEMBL9139559 0.89 P4HTM (0.50) P4HTMEGLN1KMT2ACYP2C9CYP2C19
SCHEMBL9140576 0.89 P4HTM (0.48) SMN1; SMN2P4HTMHPGDPAX8
SCHEMBL9140306 0.89 P4HTM (0.45) P4HTMFBP1KMT2ABCL2L1MCL1
SCHEMBL9140170 0.89 P4HTM (0.47) SMN1; SMN2P4HTMFBP1KMT2ABCL2L1

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-5428046-A Antifibrotic agents HOECHST AKTIENGESELLSCHAFT (DE) 1995-06-27 US disclosed