SCHEMBL9045979

SCHEMBL9045979

Cc1ccc(/C=C(\CC(=O)N2CC3CCCCC3C2)C(=O)O)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 2/20 0.38
AKR1C3 P42330 1/20 0.38
FFAR1 O14842 1/20 0.36
MAPT P10636 3/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
EPHX2 P34913 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.35
USP2 O75604 1/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
DPEP1 P16444 1/20 0.35

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
SCHEMBL9045993 1.00 ALDH1A1 (0.40) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL9045990 1.00 ALDH1A1 (0.40) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL9045986 1.00 ALDH1A1 (0.40) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL9045983 1.00 ALDH1A1 (0.40) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL4456242 0.88 CYP3A4 (0.44) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL4454944 0.88 CYP3A4 (0.44) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL2861464 0.88 CYP3A4 (0.44) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL8170512 0.88 CYP3A4 (0.44) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL2861462 0.88 CYP3A4 (0.44) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL4456248 0.88 CYP3A4 (0.44) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP claimed
EP-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP disclosed
US-5202335-A Hypoglycemic, antidiabetic agents KISSEI PHARMACEUTICAL CO., LTD. (JP) 1993-04-13 US disclosed
EP-0507534-A1 Succinic acid compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP disclosed