SCHEMBL8486571

SCHEMBL8486571

Cc1ccc(C(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
LMNA P02545 3/20 0.53
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
POLB P06746 1/20 0.49
GAA P10253 4/20 0.48
KMT2A Q03164 2/20 0.48
SRD5A2 P31213 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL634085 0.88 ALDH1A1 (0.79) ALDH1A1LMNAMAPTSMN1; SMN2HPGD
SCHEMBL7895365 0.87 MEN1 (0.54) ALDH1A1LMNAMAPTSMN1; SMN2HPGD
SCHEMBL7802270 0.85 FLT1 (0.54) ALDH1A1MAPTSMN1; SMN2CA1CA2
SCHEMBL7811320 0.85 ALDH1A1 (0.65) ALDH1A1LMNAMAPTSMN1; SMN2CA1
SCHEMBL7814081 0.85 KAT6A (0.49) ALDH1A1LMNAMAPTSMN1; SMN2HPGD
SCHEMBL7807017 0.81 FLT1 (0.50) ALDH1A1LMNAMAPTSMN1; SMN2HPGD
SCHEMBL7810601 0.81 HDAC1 (0.47) ALDH1A1LMNAMAPTSMN1; SMN2HPGD
SCHEMBL7807045 0.81 ALDH1A1 (0.46) ALDH1A1LMNAMAPTSMN1; SMN2HPGD
SCHEMBL3716571 0.81 ALDH1A1 (0.54) ALDH1A1LMNAMAPTSMN1; SMN2HPGD
SCHEMBL3643243 0.81 ALDH1A1 (0.58) ALDH1A1LMNAMAPTSMN1; SMN2HPGD

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
US-5972950-A ANTIINFLAMMATORY AND ANALGESIC AGENT LABORATORIES UPSA (FR) 1999-10-26 US disclosed
WO-1998015528-A1 NOVEL DIARYLMETHYLENE DERIVATIVES, METHOD FOR PREPARING AND THERAPEUTIC USES THEREOF LABORATOIRES UPSA (FR) 1998-04-16 WO disclosed