SCHEMBL9274499

SCHEMBL9274499

CCc1cccc(CC)c1NC(=O)NC1CCC(c2ccccc2)(c2ccccc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.51
▸ TP53 P04637 1/20 0.46
▸ EPHX1 P07099 3/20 0.45
▸ CACNA1C Q13936 2/20 0.44
▸ SCN5A Q14524 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ EPHX2 P34913 2/20 0.43
▸ OPRM1 P35372 3/20 0.42
▸ OPRL1 P41146 3/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ MAPT P10636 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ PYGL P06737 1/20 0.41
▸ NPC1 O15118 1/20 0.40

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
SCHEMBL9266884 0.81 EPHX2 (0.54) KMT2AEPHX1EPHX2ALDH1A1
SCHEMBL9272996 0.80 KMT2A (0.53) KMT2ATP53EPHX1
SCHEMBL9274428 0.79 KMT2A (0.62) KMT2AEPHX1SMN1; SMN2EPHX2RAB9A
SCHEMBL19628960 0.77 KCNA3 (0.55) KMT2AEPHX2OPRM1OPRL1RAB9A
SCHEMBL9273456 0.76 KMT2A (0.49) KMT2ATP53EPHX1SMN1; SMN2EPHX2
SCHEMBL9640303 0.74 CNR1 (0.58) KMT2ATP53CACNA1CSCN5ASMN1; SMN2
SCHEMBL9641008 0.73 CACNA1C (0.47) CACNA1CSCN5AMAPTNPSR1KDM4E
SCHEMBL9641210 0.73 CACNA1C (0.47) CACNA1CSCN5AMAPTNPSR1KDM4E
SCHEMBL9641110 0.72 LMNA (0.57) KMT2ATP53SMN1; SMN2NPSR1ALDH1A1
SCHEMBL9270478 0.71 EPHX2 (0.69) KMT2AEPHX2RAB9AMAPTALDH1A1

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-5420164-A Enzyme inhibitors YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-05-30 — — US disclosed
EP-0507291-A1 Cyclohexylurea compounds YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-10-07 — — EP disclosed
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