SCHEMBL4722608

SCHEMBL4722608

CCOc1n[c]oc1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.41
KDM4E B2RXH2 7/20 0.41
ALDH1A1 P00352 6/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
SQOR Q9Y6N5 1/20 0.38
HSD17B10 Q99714 8/20 0.38
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HTT P42858 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
GAA P10253 1/20 0.36
THRB P10828 1/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 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
SCHEMBL4724586 0.87 ALDH1A1 (0.37) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL4723120 0.86 MAPK1 (0.42) HPGDKDM4EALDH1A1TP53SMN1; SMN2
SCHEMBL4724450 0.81 NPC1 (0.39) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL17625982 0.77 SMN1; SMN2 (0.52) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL8848188 0.74 HEXA (0.38) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL4722610 0.73 NPC1 (0.41) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL8848399 0.71 KDM4E (0.37) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL4511404 0.71 BRD4 (0.38) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL4721791 0.70 ALDH1A1 (0.41) HPGDKDM4EALDH1A1NPC1RAB9A
SCHEMBL7374814 0.70 TP53 (0.43) HPGDKDM4EALDH1A1NPC1RAB9A

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 3 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
EP-1874780-A1 4-PIPERAZINYLTHIENO[2,3-D]PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2008-01-09 EP disclosed
WO-2006100591-A1 4-PIPERAZINNYLTHIENO [2,3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-09-28 WO 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 HPGD 800/4885KDM4E 2584/4885ALDH1A1 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.