SCHEMBL1483090

SCHEMBL1483090

COC(=O)Cc1ccc(Cn2c(-c3ccc(Cl)cc3O)nc3cc(F)c(F)cc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 7/20 0.46
DRD2 P14416 2/20 0.46
KDM4E B2RXH2 1/20 0.41
KMT2A Q03164 2/20 0.39
SOS1 Q07889 2/20 0.38
NR1H4 Q96RI1 2/20 0.38
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPK1 P28482 1/20 0.37
RHEB Q15382 1/20 0.36
DCTPP1 Q9H773 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL1482801 0.90 TBXA2R (0.44) TBXA2RDRD2KDM4EKMT2ANR1H4
SCHEMBL1482913 0.90 KDM4E (0.48) TBXA2RDRD2KDM4EKMT2ASOS1
SCHEMBL1482209 0.89 LPAR2 (0.42) TBXA2RDRD2KDM4ENR1H4HTT
SCHEMBL1483096 0.88 DRD2 (0.55) TBXA2RDRD2MAPTDCTPP1GAA
SCHEMBL1482644 0.84 NR1H4 (0.43) TBXA2RDRD2NR1H4
SCHEMBL1482490 0.83 DRD2 (0.49) TBXA2RDRD2KMT2AMAPT
SCHEMBL1482410 0.82 KMT2A (0.52) KDM4EKMT2AMAPTHTTSMN1; SMN2
SCHEMBL1482695 0.82 MCHR1 (0.39) KDM4ENR1H4MAPT
SCHEMBL1482665 0.81 KDM4E (0.47) TBXA2RDRD2KDM4EKMT2ANR1H4
SCHEMBL1482341 0.80 KMT2A (0.47) KMT2ASOS1MAPTHTTSMN1; SMN2

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-8309581-B2 Benzimidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2012-11-13 US disclosed
US-20110077273-A1 NEW BENZIMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-03-31 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-20110077273-A1 NEW BENZIMIDAZOLE DERIVATIVES BRI3BP, CYP3A4, RB1 TBXA2R 92/4885DRD2 1464/4885KDM4E 1791/4885

“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.