SCHEMBL8252433

SCHEMBL8252433

CCCCOc1ccc(C)nc1Cn1c(O)nc2ccc(CO)cc21

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ S1PR4 O95977 1/20 0.36
▸ TLR7 Q9NYK1 4/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ IL6 P05231 2/20 0.34
▸ AGTR1 P30556 2/20 0.34
▸ AGTR2 P50052 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ PDE2A O00408 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL8247680 0.89 TLR8 (0.42) TLR7IL6ALDH1A1
SCHEMBL8251906 0.86 AGTR2 (0.39) S1PR4TLR7AGTR1AGTR2
SCHEMBL8242374 0.86 AGTR2 (0.39) TLR7AGTR1AGTR2
SCHEMBL8242381 0.85 TLR7 (0.35) S1PR4TLR7IL6AGTR1AGTR2
SCHEMBL8249741 0.85 F2 (0.36) S1PR4TLR7IL6AGTR1AGTR2
SCHEMBL16327722 0.85 ALOX5AP (0.33) S1PR4PDE10AMAPTAGTR1AGTR2
SCHEMBL12884189 0.85 CSF1R (0.44) MAPTKDM4E
SCHEMBL8248706 0.84 HTT (0.46) AGTR1AGTR2KDM4EALDH1A1
SCHEMBL8242386 0.81 KDM4E (0.48) PDE10AMAPTKDM4EPDE2AALDH1A1
SCHEMBL8251311 0.79 TLR8 (0.42) S1PR4ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1896450-B1 2-SUBSTITUTED BENZIMIDAZOLES JANSSEN R & D IRELAND (IE) 2012-08-15 — — EP disclosed
US-7884215-B2 2-substituted benzimidazoles JANSSEN SCIENCES IRELAND UC (IE) 2011-02-08 — — US disclosed
US-20100092426-A1 2-SUBSTITUTED BENZIMIDAZOLES JANSSEN SCIENCES IRELAND UC (IE) 2010-04-15 — — US disclosed
WO-2006136563-A1 2-SUBSTITUTED BENZIMIDAZOLES TIBOTEC PHARMACEUTICALS LTD (IE) 2006-12-28 — — 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-20100092426-A1 2-SUBSTITUTED BENZIMIDAZOLES HTR4, HRH4, HTR3C S1PR4 184/4885TLR7 1446/4885PDE10A 4726/4885

“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.

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