SCHEMBL11373545

SCHEMBL11373545

Cc1nc(NC(=O)NC(=O)c2ccccc2Cl)cnc1-c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.44
GCGR P47871 1/20 0.43
DYRK1A Q13627 2/20 0.43
PCTP Q9UKL6 1/20 0.43
NPC1 O15118 6/20 0.43
RAB9A P51151 6/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
SMO Q99835 1/20 0.43
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 2/20 0.42
POLB P06746 2/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.41
GSK3B P49841 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL11371270 0.94 SMO (0.47) DYRK1APCTPNPC1RAB9ACYP1A2
SCHEMBL11379838 0.94 CNR1 (0.46) CNR1DYRK1APCTPNPC1RAB9A
SCHEMBL11384812 0.93 SMO (0.47) PCTPNPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL7628324 0.92 PCTP (0.42) DYRK1APCTPNPC1RAB9ASMN1; SMN2
SCHEMBL11370506 0.92 GAA (0.42) DYRK1APCTPNPC1RAB9ASMN1; SMN2
SCHEMBL11373838 0.90 POLB (0.43) DYRK1APCTPNPC1RAB9ASMN1; SMN2
SCHEMBL11374776 0.90 PCTP (0.43) DYRK1APCTPNPC1RAB9ASMN1; SMN2
SCHEMBL8667778 0.90 GHSR (0.51) CNR1GCGRNPC1RAB9ASMN1; SMN2
SCHEMBL11388831 0.89 GCGR (0.45) CNR1GCGRDYRK1APCTPNPC1
SCHEMBL11525837 0.88 CNR1 (0.42) CNR1NPC1RAB9ASMN1; SMN2ALDH1A1

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-4293552-A Novel 1-(mono-o-substituted benzoyl)-3-(substituted pyrazinyl) ureas ELI LILLY AND COMPANY (US) 1981-10-06 US claimed
US-4293552-A Novel 1-(mono-o-substituted benzoyl)-3-(substituted pyrazinyl) ureas ELI LILLY AND COMPANY (US) 1981-10-06 US disclosed