SCHEMBL7471605

SCHEMBL7471605

CCCCCNc1nc(C)c(-c2ccc(O/C(F)=C/I)cc2Cl)nc1OC

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 17/20 0.51
CNR1 P21554 2/20 0.36
CDC7 O00311 1/20 0.34
DBF4 Q9UBU7 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
SCHEMBL5415489 0.84 CRHR1 (0.73) CRHR1
SCHEMBL5415514 0.84 CRHR1 (0.73) CRHR1
SCHEMBL7475201 0.83 CRHR1 (0.68) CRHR1CNR1
SCHEMBL7474607 0.83 CRHR1 (0.60) CRHR1CNR1
SCHEMBL7477544 0.80 CRHR1 (0.55) CRHR1CNR1
SCHEMBL6203740 0.79 CRHR1 (0.54) CRHR1
SCHEMBL7479379 0.77 CRHR1 (0.57) CRHR1
SCHEMBL7477663 0.75 CRHR1 (0.45) CRHR1
SCHEMBL7482544 0.75 CRHR1 (0.52) CRHR1
SCHEMBL6202450 0.74 CRHR1 (0.56) CRHR1

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
EP-1255740-A2 SUBSTITUTED ARYLPYRAZINES NEUROGEN CORPORATION (US) 2002-11-13 EP disclosed
WO-2001060806-A2 SUBSTITUTED ARYLPYRAZINES NEUROGEN CORPORATION (US) 2001-08-23 WO disclosed