SCHEMBL9332922

SCHEMBL9332922

CC(=O)Nc1ccc(Cl)cc1I

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.62
▸ HSD17B10 Q99714 1/20 0.62
▸ CA1 P00915 2/20 0.57
▸ CA2 P00918 2/20 0.57
▸ CA9 Q16790 2/20 0.57
▸ HDAC1 Q13547 1/20 0.50
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ POLB P06746 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ EPHX1 P07099 1/20 0.45
▸ GRIK1 P39086 1/20 0.44
▸ KMT2A Q03164 1/20 0.43
▸ PTK2 Q05397 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ USP2 O75604 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ DYRK1A Q13627 1/20 0.43
▸ FSCN1 Q16658 1/20 0.43
▸ ALDH1A1 P00352 2/20 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
SCHEMBL2434637 0.83 GRIK1 (0.49) KDM4EHSD17B10NPC1RAB9APOLB
SCHEMBL3782005 0.82 KDM4E (0.68) KDM4EHSD17B10CA1CA2CA9
SCHEMBL22501545 0.82 CA1 (0.54) KDM4EHSD17B10CA1CA2CA9
SCHEMBL13283740 0.81 NPC1 (0.50) KDM4EHSD17B10CA1CA2CA9
SCHEMBL11636436 0.81 KDM4E (0.71) KDM4EHSD17B10CA1CA2CA9
SCHEMBL29822237 0.81 KDM4E (0.66) KDM4EHSD17B10CA1CA2CA9
SCHEMBL4311940 0.81 KDM4E (0.66) KDM4EHSD17B10CA1CA2CA9
SCHEMBL10852754 0.81 CA1 (0.60) KDM4EHSD17B10CA1CA2CA9
SCHEMBL15643309 0.81 ALDH1A1 (0.57) KDM4EHSD17B10NPC1RAB9APOLB
SCHEMBL1952367 0.79 POLB (0.67) KDM4EHSD17B10CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0376103-B1 A 2-acylamino-5-halogenated-cinnamic acid derivative and method for its production NIPPON KAYAKU KK (JP) 1994-04-20 — — EP disclosed
US-4997972-A 2-acylamino-5-halogenated-cinnamic acid derivative and method for its production NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1991-03-05 — — US disclosed
EP-0376103-A1 A 2-acylamino-5-halogenated-cinnamic acid derivative and method for its production Nippon Kayaku Kabushiki Kaisha (JP) 1990-07-04 — — EP disclosed
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