SCHEMBL8990054

SCHEMBL8990054

NC(=O)Cc1cccc(C(=O)c2ccc(Cl)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ VNN1 O95497 1/20 0.45
▸ MRGPRX4 Q96LA9 1/20 0.44
▸ SRD5A2 P31213 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ GRIN2B Q13224 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ CNR2 P34972 1/20 0.44
▸ ATM Q13315 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ HTR3E A5X5Y0 1/20 0.42
▸ HTR3B O95264 1/20 0.42
▸ HTR3A P46098 1/20 0.42
▸ HTR3D Q70Z44 1/20 0.42
▸ HTR3C Q8WXA8 1/20 0.42
▸ PARP1 P09874 1/20 0.42
▸ NPC1 O15118 1/20 0.42

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
SCHEMBL11445035 0.86 L3MBTL1 (0.51) L3MBTL1MAPTMRGPRX4SRD5A2MAPK1
SCHEMBL11541766 0.86 L3MBTL1 (0.47) L3MBTL1MAPTVNN1MRGPRX4SRD5A2
SCHEMBL8990053 0.84 CTSL (0.49) L3MBTL1MAPK1GRIN2BATMTDP1
Hydrochloric Acid SCHEMBL11541768 0.84 L3MBTL1 (0.50) L3MBTL1MAPTVNN1MRGPRX4SRD5A2
SCHEMBL14302252 0.81 SRD5A2 (0.47) L3MBTL1MAPTVNN1MRGPRX4SRD5A2
SCHEMBL7015547 0.81 SRD5A2 (0.47) L3MBTL1MAPTMRGPRX4SRD5A2MAPK1
SCHEMBL11445117 0.81 HPGD (0.47) L3MBTL1MAPTMRGPRX4HTTKMT2A
SCHEMBL809735 0.79 ATM (0.67) L3MBTL1SRD5A2MAPK1CNR2ATM
SCHEMBL1395822 0.78 HTR3E (0.67) KMT2AHTR3EHTR3BHTR3AHTR3D
SCHEMBL3054667 0.78 PARP1 (0.53) L3MBTL1MAPTTDP1PARP1

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
EP-0716600-A1 TOPICALLY ADMINISTRABLE COMPOSITIONS CONTAINING 3-BENZOYLPHENYLACETIC ACID DERIVATIVES FOR TREATMENT OF OPHTHALMIC INFLAMMATORY DISORDERS ALCON LABORATORIES, INC. (US) 1996-06-19 — — EP claimed
WO-1995033457-A1 TOPICALLY ADMINISTRABLE COMPOSITIONS CONTAINING 3-BENZOYLPHENYLACETIC ACID DERIVATIVES FOR TREATMENT OF OPHTHALMIC INFLAMMATORY DISORDERS ALCON LABORATORIES, INC. (US) 1995-12-14 — — WO claimed
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