SCHEMBL10692622

SCHEMBL10692622

CN1C(=O)C(Cc2ccccc2)(c2ccc(O)cc2)Cc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.39
GPR55 Q9Y2T6 2/20 0.39
EHMT2 Q96KQ7 1/20 0.37
NR3C1 P04150 1/20 0.37
AR P10275 1/20 0.37
PKM P14618 1/20 0.36
ESR2 Q92731 3/20 0.36
BACE1 P56817 1/20 0.36
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ESR1 P03372 2/20 0.35
GRIN2B Q13224 3/20 0.34
SLC6A2 P23975 1/20 0.34
RIPK1 Q13546 1/20 0.34
HTR7 P34969 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33

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
SCHEMBL10695891 0.87 OPRD1 (0.41) NR3C1ARESR2
SCHEMBL10693883 0.86 BACE1 (0.44) NR3C1ARBACE1LMNAHTT
SCHEMBL10692682 0.83 NPC1 (0.47) EHMT2NR3C1ARPKMBACE1
SCHEMBL10692592 0.78 BACE1 (0.44) ARBACE1
SCHEMBL10695992 0.76 SCN9A (0.39) ARLMNAL3MBTL1HTR7
SCHEMBL10691351 0.73 GPR55 (0.39) CNR1GPR55EHMT2PKMESR2
SCHEMBL10694576 0.73 POLB (0.33) PKMBACE1LMNAHTTHTR7
SCHEMBL10694392 0.71 NPC1 (0.47) CNR1GPR55EHMT2PKMLMNA
SCHEMBL20714380 0.71 L3MBTL1 (0.41) EHMT2BACE1LMNAHTTNPSR1
SCHEMBL20710608 0.68 ALDH1A1 (0.57) SLC6A2

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-4778793-A CONTROLLING CALCIUM CONCENTRATION-CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1988-10-18 US disclosed
EP-0212216-A1 Dihydroquinolinone derivatives, processes for their preparation, medicaments containing them, the use of these medicaments, and intermediates for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-04 EP disclosed