SCHEMBL2315975

SCHEMBL2315975

Cc1cn2cccc(CO)c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.38
RAB9A P51151 7/20 0.38
ALDH1A1 P00352 7/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
KDM4E B2RXH2 4/20 0.38
HSD17B10 Q99714 3/20 0.38
TP53 P04637 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HPGD P15428 2/20 0.38
TSHR P16473 1/20 0.38
GRM5 P41594 6/20 0.38
NFKB1 P19838 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 3/20 0.37
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36

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
SCHEMBL14679607 0.84 ALDH1A1 (0.39) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL10916520 0.83 NPC1 (0.39) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL11071233 0.81 ACP3 (0.41) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL14679615 0.80 GABRA1 (0.38) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL10517019 0.79 GRM5 (0.38) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL2313781 0.79 NPC1 (0.35) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL2316889 0.79 HTR4 (0.44) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL2194531 0.78 ATP4A (0.55) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL23107051 0.77 SUV39H2 (0.33) NPC1RAB9AALDH1A1KDM4EHSD17B10
SCHEMBL4003688 0.77 ALDH1A1 (0.50) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E

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
US-8404707-B2 Imidazo [1, 2-a] pyrrolo [3, 2-c] pyridine compounds useful as pestivirus inhibitors UNIVERSITE D'AUVERGNE CLERMONT 1 (FR) 2013-03-26 US disclosed
EP-2125807-B1 IMIDAZO[1,2-A]PYRROLO[3,2-C]PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS UNIV LEUVEN KATH (BE) 2011-08-03 EP disclosed
US-20100093781-A1 IMIDAZO [1, 2-A] PYRROLO [3, 2-C] PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS UNIVERSITE D'AUVERGNE CLERMONT 1 (FR) 2010-04-15 US disclosed
EP-0068378-B1 NOVEL IMIDAZO(1,2-A)PYRIDINES AND PYRAZINES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1986-03-05 EP disclosed
US-4450164-A ANTIULCER AND ANTISECRETORY AGENTS SCHERING CORPORATION (US) 1984-05-22 US 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-20100093781-A1 IMIDAZO [1, 2-A] PYRROLO [3, 2-C] PYRIDINE COMPOUNDS USEFUL AS PESTIVIRUS INHIBITORS PPM1D, CDKN1A, PPM1A NPC1 4131/4885RAB9A 880/4885ALDH1A1 1442/4885

“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.