SCHEMBL24846337

SCHEMBL24846337

Cc1ccccc1-n1c(CSc2nc(N)nc3nc[nH]c23)nc2cccc(C)c2c1=O

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 10/20 0.71
PIK3CD O00329 8/20 0.57
PIK3CB P42338 2/20 0.55
POLB P06746 2/20 0.52
RECQL P46063 1/20 0.52
PIN1 Q13526 1/20 0.50
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
PIK3R1 P27986 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL7041562 0.90 PIK3CG (0.68) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL734675 0.86 PIK3CG (0.61) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL24846340 0.83 POLB (0.54) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL16004753 0.83 PIK3CG (1.00) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL734881 0.80 PIK3CG (0.68) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL24846338 0.78 ALDH1A1 (0.75) PIK3CGPOLBRECQLPIN1ALDH1A1
SCHEMBL734311 0.77 PIK3CG (0.59) PIK3CGPIK3CDPIK3CBPIK3R1
SCHEMBL7174836 0.77 PIK3CG (0.59) PIK3CGPIK3CDPIK3CBPIK3R1
SCHEMBL734001 0.77 PIK3CG (0.59) PIK3CGPIK3CDPIK3CBPOLBRECQL
SCHEMBL733666 0.77 PIK3CG (0.55) PIK3CGPIK3CDPIK3CBPIK3R1

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-20230002387-A1 2-AMINO-S6-SUBSTITUTED THIOPURINE COMPOUNDS AS INHIBITORS OF THE ENPP1 PROTEIN ATEN PORUS LIFESCIENCES PVT. LTD. (IN) 2023-01-05 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-20230002387-A1 2-AMINO-S6-SUBSTITUTED THIOPURINE COMPOUNDS AS INHIBITORS OF THE ENPP1 PROTEIN ENPP1, ENPP3, PNP PIK3CG 802/4885PIK3CD 630/4885PIK3CB 794/4885

“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.