SCHEMBL30947348

SCHEMBL30947348

COc1ccc(CN(Cc2ccc(OC)cc2)c2nc3ccccc3c(NCc3ccc(CN4CCCC4)s3)c2N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 7/20 0.45
PTGDR Q13258 1/20 0.41
BCHE P06276 1/20 0.40
APP P05067 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NCF1 P14598 1/20 0.39
EGFR P00533 1/20 0.38
RAB9A P51151 1/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
HBB P68871 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 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
SCHEMBL30947344 0.89 ACP1 (0.56) ACP1BCHEAPPMEN1KMT2A
SCHEMBL24732681 0.89 ACP1 (0.56) ACP1BCHEAPPMEN1KMT2A
SCHEMBL30947363 0.87 EGFR (0.52) ACP1PTGDRBCHEMEN1KMT2A
SCHEMBL30947362 0.87 EGFR (0.52) ACP1PTGDRBCHEMEN1KMT2A
SCHEMBL24732635 0.84 ACP1 (0.47) ACP1BCHEAPPMEN1KMT2A
SCHEMBL30947350 0.84 ACP1 (0.47) ACP1BCHEAPPMEN1KMT2A
SCHEMBL24733058 0.83 ACP1 (0.49) ACP1BCHEAPPMEN1KMT2A
SCHEMBL29977635 0.83 ACP1 (0.49) ACP1BCHEAPPMEN1KMT2A
SCHEMBL24732638 0.80 ACP1 (0.48) ACP1MEN1KMT2ARAB9A
SCHEMBL30947349 0.80 ACP1 (0.48) ACP1MEN1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF INNOVSTONE THERAPEUTICS LIMITED (CN) 2024-05-09 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-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF TLR7, TLR1, TLR8 ACP1 3773/4885PTGDR 1572/4885BCHE 2952/4885

“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.