SCHEMBL7844747

SCHEMBL7844747

Cc1cc(F)ccc1C1=CCNC(Cc2ccccc2)C1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 4/20 0.35
CCNT1 O60563 3/20 0.35
HTR6 P50406 1/20 0.34
OXTR P30559 1/20 0.34
AVPR1A P37288 1/20 0.34
POLB P06746 1/20 0.34
HTR2A P28223 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
KCNH2 Q12809 1/20 0.34

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
SCHEMBL6961333 0.79 POLB (0.39) POLBHTR2A
SCHEMBL7560334 0.79 POLB (0.39) POLB
SCHEMBL6504166 0.78 POLB (0.34) POLB
SCHEMBL5164747 0.77 CDK9 (0.37) CDK9CCNT1POLB
SCHEMBL6683579 0.74 POLB (0.37) POLB
SCHEMBL5265951 0.74 POLB (0.44) POLB
Hydrochloric Acid SCHEMBL18304929 0.73 GPBAR1 (0.30)
SCHEMBL6506502 0.72 POLB (0.35) POLB
SCHEMBL8368017 0.72 SLC6A3 (0.37) POLB
SCHEMBL10648673 0.71 CHRNB2 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140876-A1 MORPHOLINONE AND MORPHOLINE DERIVATIVES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2001-10-10 EP disclosed
WO-2000035891-A1 MORPHOLINONE AND MORPHOLINE DERIVATIVES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-06-22 WO disclosed
WO-1998051311-A2 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-11-19 WO disclosed