SCHEMBL9722707

SCHEMBL9722707

O=C(COc1cc(Cl)ccc1Cl)N1CCNC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 1/20 1.00
▸ CRHR2 Q13324 1/20 1.00
▸ GAA P10253 3/20 0.56
▸ HTT P42858 2/20 0.49
▸ TSHR P16473 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HPGD P15428 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ LMNA P02545 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ POLB P06746 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
SCHEMBL9722711 0.76 CRHBP (0.61) CRHBPCRHR2GAAHTTSMN1; SMN2
SCHEMBL11861407 0.72 GAA (1.00) CRHBPCRHR2GAAHTTSMN1; SMN2
SCHEMBL5061103 0.71 CCR1 (0.60) CRHBPCRHR2GAAHTTTSHR
SCHEMBL64347 0.71 TDP1 (0.74) CRHBPCRHR2TSHRMAPTMEN1
SCHEMBL9722688 0.71 TDP1 (0.54) CRHBPCRHR2HTTTSHRSMN1; SMN2
SCHEMBL16738475 0.71 GPBAR1 (0.65) CRHBPCRHR2
SCHEMBL655032 0.68 HTT (0.78) GAAHTTTSHRSMN1; SMN2HPGD
SCHEMBL18716598 0.68 GAA (0.58) CRHBPCRHR2GAATSHRSMN1; SMN2
SCHEMBL9722699 0.68 CRHBP (0.51) CRHBPCRHR2GAAHTTTSHR
SCHEMBL11812771 0.66 MEN1 (0.52) CRHBPCRHR2HTTTSHRSMN1; SMN2

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-5139564-A Applying postemergence PARK SANG W (KR) 1992-08-18 — — US disclosed
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