SCHEMBL10490000

SCHEMBL10490000

CCc1cccc(NC(=O)Oc2cc(C)cs2)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HPGD P15428 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ FTO Q9C0B1 3/20 0.38
▸ GAA P10253 1/20 0.37
▸ CLCN2 P51788 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KCNK3 O14649 1/20 0.36
▸ KCNK9 Q9NPC2 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NLRP3 Q96P20 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
SCHEMBL10489876 0.79 RAB9A (0.50) KMT2AMEN1ALDH1A1HPGDGAA
SCHEMBL10489851 0.79 ALDH1A1 (0.56) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL10489739 0.79 CLCN2 (0.45) ALDH1A1HPGDFTOCLCN2KCNK3
SCHEMBL10489904 0.76 RAB9A (0.60) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL10489678 0.76 ALDH1A1 (0.54) KMT2AMEN1ALDH1A1HPGDGAA
SCHEMBL10489988 0.76 FAAH (0.46) KMT2AMEN1ALDH1A1GAA
SCHEMBL10489688 0.74 HPGD (0.48) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL10489991 0.73 RAB9A (0.44) KMT2AMEN1ALDH1A1HPGDGAA
SCHEMBL10489681 0.72 NPC1 (0.62) KMT2AALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL10489848 0.72 SMN1; SMN2 (0.56) ALDH1A1HPGDLMNAGAACYP1A2

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-4873232-A ARTHRITIS AND AUTOIMMUNE DISEASES SYNTEX (US) 1989-10-10 — — US disclosed
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