SCHEMBL3723325

SCHEMBL3723325

Cc1cccc(-c2cc(-c3cncc(-c4ccc(C(=O)N5CCN(C(C)C)CC5)cc4)c3)cc(O)n2)n1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.44
GRM5 P41594 1/20 0.42
ABL1 P00519 4/20 0.40
BCR P11274 4/20 0.40
CCNC P24863 2/20 0.40
CDK8 P49336 2/20 0.40
SLC6A7 Q99884 1/20 0.40
CHRNA7 P36544 1/20 0.40
MET P08581 1/20 0.39
CYP1A2 P05177 1/20 0.39
TACR3 P29371 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL3662773 0.90 HRH3 (0.43) HRH3GRM5ABL1BCRCCNC
SCHEMBL3660847 0.84 HRH3 (0.44) HRH3GRM5ABL1BCRCCNC
SCHEMBL3725926 0.82 PARP1 (0.40) HRH3
SCHEMBL3656411 0.82 ABL1 (0.44) HRH3ABL1BCRCCNCCDK8
SCHEMBL4175579 0.80 POLB (0.46) GRM5ABL1BCRCCNCCDK8
SCHEMBL3728093 0.78 F12 (0.48) HRH3ABL1BCRSLC6A7MET
SCHEMBL3659562 0.78 HRH3 (0.45) HRH3GRM5ABL1BCRSLC6A7
SCHEMBL3717402 0.78 BMPR1B (0.45) GRM5CCNCCDK8
SCHEMBL13743227 0.78 HRH3 (0.53) HRH3CCNCCDK8SLC6A7CHRNA7
SCHEMBL3658377 0.77 ABL1 (0.45) HRH3ABL1BCRSLC6A7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2242742-B1 PYRIDINE DERIVATIVES NOVARTIS AG (CH) 2015-12-02 EP disclosed
US-8343966-B2 Organic compounds NOVARTIS AG (CH) 2013-01-01 US disclosed
EP-2242742-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2010-10-27 EP disclosed
US-20090215776-A1 Organic compounds ADCOCK CLAIRE 2009-08-27 US disclosed
WO-2009087212-A2 PYRIDINE DERIVATIVES NOVARTIS AG (CH) 2009-07-16 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-20090215776-A1 Organic compounds REN, RXFP1, MYLK HRH3 453/4885GRM5 4235/4885ABL1 3285/4885

“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.