SCHEMBL28627102

SCHEMBL28627102

NC(=O)c1ccc(Cl)cc1Cl.O=C(O)CCC1CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ TSHR P16473 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ MAPT P10636 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ PSEN1 P49768 1/20 0.42
▸ PSEN2 P49810 1/20 0.42
▸ APH1B Q8WW43 1/20 0.42
▸ NCSTN Q92542 1/20 0.42
▸ APH1A Q96BI3 1/20 0.42
▸ PSENEN Q9NZ42 1/20 0.42
▸ ERCC5 P28715 1/20 0.42
▸ FEN1 P39748 1/20 0.42
▸ HPGD P15428 3/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ HTT P42858 2/20 0.41

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
SCHEMBL29506761 0.78 SMN1; SMN2 (0.65) SMN1; SMN2TSHRCASP1MAPTKDM4E
SCHEMBL325007 0.78 SMN1; SMN2 (0.65) SMN1; SMN2TSHRCASP1MAPTKDM4E
Cyclopropane Carboxylic Acid SCHEMBL28423298 0.78 SMN1; SMN2 (0.53) SMN1; SMN2TSHRCASP1MAPTKDM4E
Cyclopropane SCHEMBL29077525 0.77 SMN1; SMN2 (0.59) SMN1; SMN2TSHRCASP1MAPTKDM4E
Hydrochloric Acid SCHEMBL4374969 0.77 SMN1; SMN2 (0.63) SMN1; SMN2TSHRCASP1MAPTKDM4E
Hydrochloric Acid SCHEMBL29192938 0.77 SMN1; SMN2 (0.63) SMN1; SMN2TSHRCASP1MAPTKDM4E
SCHEMBL10617951 0.72 ALDH1A1 (0.54) SMN1; SMN2TSHRCASP1MAPTKDM4E
SCHEMBL13715900 0.71 ALDH1A1 (0.61) SMN1; SMN2TSHRCASP1MAPTKDM4E
SCHEMBL28402027 0.71 L3MBTL1 (0.44) SMN1; SMN2TSHRCASP1MAPTKDM4E
SCHEMBL481408 0.71 ALDH1A1 (0.65) SMN1; SMN2TSHRCASP1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113317322-B Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof 郑州郑氏化工产品有限公司 2022-04-05 — — CN claimed
CN-113317322-A Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof 郑州郑氏化工产品有限公司 2021-08-31 — — CN claimed
CN-113317322-B Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof 郑州郑氏化工产品有限公司 2022-04-05 — — CN disclosed
CN-113317322-A Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof 郑州郑氏化工产品有限公司 2021-08-31 — — CN disclosed
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