SCHEMBL9924109

SCHEMBL9924109

Cc1ccc(C(C)(c2ccc(OCc3ccccn3)cn2)C(C)C)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.63
SYK P43405 4/20 0.43
AURKB Q96GD4 2/20 0.42
INCENP Q9NQS7 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
ADAMTS4 O75173 1/20 0.39
PARP10 Q53GL7 1/20 0.38
MAOB P27338 1/20 0.38
MAPT P10636 1/20 0.37
HTR5A P47898 1/20 0.37
HTT P42858 2/20 0.37
LMNA P02545 1/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL14275821 0.93 ALOX5AP (0.66) ALOX5APSYKAURKBINCENPSMN1; SMN2
SCHEMBL708956 0.90 ALOX5AP (0.62) ALOX5APSYKAURKBINCENPSMN1; SMN2
SCHEMBL14397112 0.89 ALOX5AP (0.61) ALOX5APSYKAURKBINCENPSMN1; SMN2
SCHEMBL14642215 0.88 ALOX5AP (0.56) ALOX5APSYKAURKBINCENPSMN1; SMN2
SCHEMBL14396685 0.87 ALOX5AP (0.48) ALOX5APSMN1; SMN2KDM4EALDH1A1HTT
SCHEMBL707618 0.87 ALOX5AP (0.62) ALOX5APSMN1; SMN2KDM4EALDH1A1ADAMTS4
SCHEMBL9924108 0.87 ALOX5AP (0.59) ALOX5APSYKAURKBINCENPSMN1; SMN2
SCHEMBL480305 0.86 ALOX5AP (0.69) ALOX5APSYKAURKBINCENPSMN1; SMN2
SCHEMBL9924147 0.85 ALOX5AP (0.73) ALOX5APSYKAURKBINCENPADAMTS4
SCHEMBL708920 0.84 ALOX5AP (0.59) ALOX5APALDH1A1ADAMTS4PARP10MAOB

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-8426413-B2 Diaryl substituted alkanes MERCK SHARP & DOHME CORP. (US) 2013-04-23 US disclosed
US-20120149674-A1 Diaryl Substituted Alkanes MERCK SHARPE & DOHME CORP. (US) 2012-06-14 US disclosed
WO-2007120574-A2 DIARYL SUBSTITUTED ALKANES MERCK & CO., INC. (US) 2007-10-25 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-20120149674-A1 Diaryl Substituted Alkanes ALOX5, ALOX15, LTB4R2 ALOX5AP 13/4885SYK 3335/4885AURKB 4319/4885

“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.