SCHEMBL10483032

SCHEMBL10483032

CC(C)Cc1ccc(C(C)CCc2cccc(C(=O)c3ccccc3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 5/20 0.45
▸ PTGS2 P35354 5/20 0.45
▸ CXCR1 P25024 4/20 0.45
▸ CXCR2 P25025 4/20 0.45
▸ LMNA P02545 3/20 0.45
▸ MAPT P10636 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ PMP22 Q01453 2/20 0.45
▸ SLC22A6 Q4U2R8 2/20 0.45
▸ CXCL8 P10145 2/20 0.45
▸ RECQL P46063 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ THPO P40225 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ CYP2C9 P11712 2/20 0.44

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
SCHEMBL6072390 0.82 ATM (0.57) PTGS1PTGS2CXCR1CXCR2LMNA
SCHEMBL5018743 0.78 PTGS1 (0.55) PTGS1PTGS2CXCR1CXCR2LMNA
SCHEMBL11843865 0.77 PTGS1 (0.53) PTGS1PTGS2CXCR1CXCR2LMNA
Ketoprofen SCHEMBL20969451 0.77 PTGS1 (0.74) PTGS1PTGS2CXCR1CXCR2LMNA
Ketoprofen SCHEMBL572766 0.77 PTGS1 (0.74) PTGS1PTGS2CXCR1CXCR2LMNA
SCHEMBL9854090 0.76 ATM (0.52) PTGS1PTGS2CXCR1CXCR2LMNA
SCHEMBL10483031 0.74 L3MBTL1 (0.47) PTGS1PTGS2CXCR1CXCR2LMNA
SCHEMBL8792890 0.73 MRGPRX4 (0.52) PTGS1PTGS2CXCR1CXCR2LMNA
SCHEMBL25146754 0.73 LOXL2 (0.44) PTGS1PTGS2CXCR1CXCR2LMNA
SCHEMBL13243743 0.72 KMT2A (0.54) SMN1; SMN2HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1203373-A — — None — — JP disclosed
JP-H01203373-A DERIVATIVE OF THIAZOLIDINE-4-CARBOXYLIC ACID HAVING PHARMACOLOGICAL ACTIVITY ZAMBON GROUP SPA 1989-08-16 — — JP disclosed
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