SCHEMBL3383277

SCHEMBL3383277

Fc1ccc(-c2ccncc2)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.56
GCGR P47871 6/20 0.56
NISCH Q9Y2I1 1/20 0.49
SRC P12931 1/20 0.46
BRAF P15056 1/20 0.46
KDR P35968 1/20 0.46
CDC7 O00311 1/20 0.45
DBF4 Q9UBU7 1/20 0.45
RPS6KA3 P51812 1/20 0.45
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44

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
SCHEMBL31067069 0.83 GRM2 (0.48) MAPK14GCGRNISCHRPS6KA3
SCHEMBL1262207 0.83 GRM2 (0.48) MAPK14GCGRNISCHRPS6KA3
SCHEMBL31066929 0.81 GRM2 (0.47) MAPK14GCGRNISCHRPS6KA3
SCHEMBL25218871 0.80 CSNK1D (0.68) MAPK14GCGRSRCBRAFKDR
SCHEMBL27746119 0.79 CYP2A6 (0.54) MAPK14GCGRNISCH
SCHEMBL29534134 0.79 AKR1C3 (0.50) MAPK14GCGRCYP11B1CYP11B2
SCHEMBL20654512 0.79 AKR1C3 (0.50) MAPK14GCGRCYP11B1CYP11B2
SCHEMBL11423973 0.79 AHR (0.57) MAPK14GCGRCDC7DBF4
SCHEMBL3363019 0.77 PIK3C3 (0.47) MAPK14NISCH
SCHEMBL22452543 0.76 TAAR1 (0.47) MAPK14GCGRNISCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963268-B1 DISUBSTITUTED PHENYLPIPERIDINES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NSAB AF NEUROSEARCH SWEDEN AB (DK) 2010-12-01 EP disclosed
US-20080269286-A1 Disubstituted Phenylpiperidines as Modulators of Cortical Catecholaminergic Neurotransmission NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2008-10-30 US disclosed
EP-1963268-A1 DISUBSTITUTED PHENYLPIPERIDINES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION Neurosearch Sweden AB (SE) 2008-09-03 EP disclosed
WO-2007065655-A1 DISUBSTITUTED PHENYLPIPERIDINES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NEUROSEARCH SWEDEN AB (SE) 2007-06-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269286-A1 Disubstituted Phenylpiperidines as Modulators of Cortical Catecholaminergic Neurotransmission SLC6A2, SLC18A2, PNMT MAPK14 1529/4885GCGR 949/4885NISCH 531/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.