SCHEMBL4922835

SCHEMBL4922835

CCCCOC1OCCO1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 1/20 0.36
EPHX1 P07099 1/20 0.35
GBA1 P04062 4/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
PPP5C P53041 1/20 0.34
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
CYP1A2 P05177 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
HTR2A P28223 1/20 0.31
MAPK1 P28482 1/20 0.31
SCN1A P35498 1/20 0.31
HTR2B P41595 1/20 0.31

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
SCHEMBL4918730 0.85
SCHEMBL600639 0.85 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1TDP1EPHX1GBA1
SCHEMBL10387316 0.82 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1TDP1GBA1ADRB2
Phosphoric Acid SCHEMBL29135113 0.81 LPAR3 (0.47) ALDH1A1TDP1GBA1
SCHEMBL10386539 0.81 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1TDP1EPHX1GBA1
SCHEMBL11797171 0.80 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1TDP1GBA1ADRB2
SCHEMBL7581801 0.79 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1TDP1EPHX1GBA1
SCHEMBL20757006 0.76 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL8043862 0.75
SCHEMBL7024093 0.74 KDM4E (0.32) ALDH1A1POLB

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-20080200475-A1 4-Piperazinothieno[2,3-D] Pyrimidine Compounds As Platelet Aggregation Inhibitors PFIZER INC. 2008-08-21 US disclosed
EP-1866317-A1 4-PIPERAZINOTHIENO [2, 3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2007-12-19 EP disclosed
WO-2006103555-A1 4-PIPERAZINOTHIENO [2, 3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-10-05 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-20080200475-A1 4-Piperazinothieno[2,3-D] Pyrimidine Compounds As Platelet Aggregation Inhibitors PF4, TBXA2R, P2RY4 SMN1; SMN2 3818/4885ALDH1A1 849/4885TDP1 1385/4885

“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.