SCHEMBL14130982

SCHEMBL14130982

CCCOc1ccc(C(=O)N2CCN(c3nc(SCC(=O)OC)nc4sc(CC)cc34)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 17/20 0.51
MEN1 O00255 2/20 0.51
ALDH1A1 P00352 3/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 1/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
CRHBP P24387 1/20 0.42
HTT P42858 1/20 0.42
CRHR2 Q13324 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL14130983 0.97 P2RY12 (0.52) P2RY12MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL14130740 0.94 P2RY12 (0.52) P2RY12MEN1ALDH1A1MAPTKMT2A
SCHEMBL4723473 0.92 P2RY12 (0.54) P2RY12MEN1ALDH1A1GAAMAPT
SCHEMBL14130826 0.92 P2RY12 (0.53) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL14130823 0.90 P2RY12 (0.54) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL4721246 0.90 P2RY12 (0.54) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL14130794 0.89 P2RY12 (0.61) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL4765245 0.89 P2RY12 (0.54) P2RY12MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL14130690 0.89 P2RY12 (0.53) P2RY12MEN1ALDH1A1KMT2A
SCHEMBL14130978 0.88 P2RY12 (0.54) P2RY12MEN1

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
US-20080176857-A1 4-Piperazinnylthieno[2,3-d]Pyrimidine Compounds as Platelet Aggregation Inhibitors PFIZER INC. 2008-07-24 US disclosed
US-20080176857-A1 4-Piperazinnylthieno[2,3-d]Pyrimidine Compounds as Platelet Aggregation Inhibitors PFIZER INC. 2008-07-24 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-20080176857-A1 4-Piperazinnylthieno[2,3-d]Pyrimidine Compounds as Platelet Aggregation Inhibitors TBXA2R, P2RY4, PF4 P2RY12 17/4885MEN1 4451/4885ALDH1A1 622/4885

“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.