SCHEMBL29410482

SCHEMBL29410482

O=C1c2ccccc2C(c2ccc(Cl)cc2)N1c1ccc2[nH]cnc2c1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 16/20 0.60
ALDH1A1 P00352 2/20 0.44
RAB9A P51151 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TP53 P04637 2/20 0.39
MDM2 Q00987 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
QPCTL Q9NXS2 1/20 0.38

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
SCHEMBL1444480 1.00 QPCT (0.60) QPCTALDH1A1RAB9AHSD17B10TP53
SCHEMBL1444692 1.00 QPCT (0.60) QPCTALDH1A1RAB9AHSD17B10TP53
SCHEMBL1444476 1.00 QPCT (0.60) QPCTALDH1A1RAB9AHSD17B10TP53
SCHEMBL1443993 0.91 QPCT (0.62) QPCTQPCTL
SCHEMBL1444481 0.90 QPCT (0.60) QPCT
SCHEMBL29410480 0.90 QPCT (0.60) QPCT
SCHEMBL1444363 0.89 QPCT (0.60) QPCTRAB9AQPCTL
SCHEMBL1673325 0.89 QPCT (0.60) QPCTQPCTL
SCHEMBL16864397 0.87 QPCT (0.48) QPCTALDH1A1RAB9AHSD17B10TP53
SCHEMBL29410549 0.87 QPCT (0.53) QPCTALDH1A1RAB9AHSD17B10TSHR

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-3658141-B1 TREATING PATHOLOGICAL CONDITIONS BY DIRECT AND INDIRECT TARGETING OF SIRPALPHA - CD47 INTERACTION STICHTING HET NEDERLANDS KANKER INST ANTONI VAN LEEUWENHOEK ZIEKENHUIS (NL) 2022-11-16 EP claimed
US-20220087981-A1 TREATING PATHOLOGICAL CONDITIONS BY DIRECT AND INDIRECT TARGETING OF SIRPA-CD47 INTERACTION Stichting Het Nederlands Kanker Instituut-Antoni van Leeuwenhoek Ziekenhuis (NL) 2022-03-24 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-20220087981-A1 TREATING PATHOLOGICAL CONDITIONS BY DIRECT AND INDIRECT TARGETING OF SIRPA-CD47 INTERACTION QPCT, QPCTL, CD47 QPCT 1/4885ALDH1A1 3827/4885RAB9A 466/4885

“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.