SCHEMBL9681838

SCHEMBL9681838

Cc1cc(C(=O)Cl)n(C2CCC2)n1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNJ6 P48051 16/20 0.40
KCNJ3 P48549 16/20 0.40
KCNJ5 P48544 14/20 0.40
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
F10 P00742 1/20 0.36

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
SCHEMBL3060712 0.97 KCNJ6 (0.42) KCNJ6KCNJ3KCNJ5KDM4EALDH1A1
SCHEMBL9682398 0.85 KCNJ3 (0.43) KCNJ6KCNJ3KCNJ5
Hydrochloric Acid SCHEMBL9681843 0.84 KCNJ3 (0.42) KCNJ6KCNJ3KCNJ5
SCHEMBL25400204 0.82 KCNJ3 (0.45) KCNJ6KCNJ3KCNJ5KDM4EALDH1A1
SCHEMBL9681221 0.79 KMT2A (0.44) KCNJ6KCNJ3KCNJ5KDM4EALDH1A1
SCHEMBL287415 0.78 NOTUM (0.41) KCNJ6KCNJ3KCNJ5KDM4E
SCHEMBL25399863 0.76 KMT2A (0.46) KCNJ6KCNJ3KCNJ5KDM4EALDH1A1
SCHEMBL29058254 0.75 KCNJ6 (0.39) KCNJ6KCNJ3KCNJ5
SCHEMBL16344633 0.75 KMT2A (0.48) KCNJ6KCNJ3KCNJ5KDM4EALDH1A1
SCHEMBL26271961 0.74 KDM4E (0.42) KCNJ6KCNJ3KCNJ5KDM4EALDH1A1

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
US-5126362-A Substituted pyrazoylacetamides NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1992-06-30 US disclosed
EP-0361362-A1 Oxime derivative and fungicide for agricultural and horticultural use NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-04-04 EP disclosed