SCHEMBL4724339

SCHEMBL4724339

CCCCN(CCCC)c1cccc2c1[CH]c1ccccc1-2

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 5/20 0.36
LMNA P02545 2/20 0.35
IDO1 P14902 1/20 0.33
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
PABPC1 P11940 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ELANE P08246 1/20 0.31
DRD3 P35462 1/20 0.31
TP53 P04637 1/20 0.31
PDK2 Q15119 1/20 0.31
UTS2R Q9UKP6 1/20 0.31
AGTR1 P30556 1/20 0.31
AGTR2 P50052 1/20 0.31
SETD7 Q8WTS6 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
SCHEMBL4724521 0.97 CRHR1 (0.40) CRHR1LMNAIDO1POLBKDM4E
SCHEMBL4721732 0.94 CRHR1 (0.39) CRHR1LMNAIDO1POLBKDM4E
SCHEMBL4765912 0.90 CRHR1 (0.40) CRHR1LMNAMEN1PABPC1KMT2A
SCHEMBL4723422 0.86 KDM4E (0.40) LMNAKDM4EALDH1A1MEN1KMT2A
SCHEMBL4723530 0.84 CRHR1 (0.35) CRHR1LMNAKDM4EMEN1KMT2A
SCHEMBL4722979 0.83 MEN1 (0.36) ALDH1A1MEN1KMT2ADRD3TP53
SCHEMBL4721790 0.79 DRD3 (0.35) CRHR1LMNAKDM4EALDH1A1MEN1
SCHEMBL4719924 0.76 TP53 (0.33) LMNAALDH1A1MEN1KMT2ATDP1
SCHEMBL7153352 0.75 TDP1 (0.44) CRHR1LMNAPOLBKDM4EALDH1A1
SCHEMBL215956 0.74 MAPT (0.43) LMNAPOLBKDM4EALDH1A1MEN1

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 CRHR1 3095/4885LMNA 2692/4885IDO1 1766/4885

“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.