SCHEMBL13262240

SCHEMBL13262240

Cc1ccc(C(C)(c2ccc(-c3ccc(-n4c(C)ccc4C)nn3)cc2)C(C)C)nc1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 3/20 0.48
▸ LMNA P02545 1/20 0.31
▸ NR1I2 O75469 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ PTGS2 P35354 1/20 0.30

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
SCHEMBL13262159 0.89 ALOX5AP (0.49) ALOX5APLMNA
SCHEMBL10199229 0.86 KDM4E (0.48) ALOX5AP
SCHEMBL10197152 0.83 ALOX5AP (0.46) ALOX5APCYP2C9
SCHEMBL10198931 0.82 ALOX5AP (0.43) ALOX5APLMNAPTGS2
SCHEMBL14397218 0.81 ALOX5AP (0.55) ALOX5APNR1I2CYP2C9PTGS2
SCHEMBL2991950 0.80 ALOX5AP (0.42) ALOX5AP
SCHEMBL2995893 0.80 ALOX5AP (0.38) ALOX5APLMNA
SCHEMBL13262244 0.79 ALOX5AP (0.47) ALOX5AP
SCHEMBL707986 0.77 ALOX5AP (0.53) ALOX5APPTGS2
SCHEMBL14397114 0.77 ALOX5AP (0.53) ALOX5APPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168076-A1 DIPHENYL SUBSTITUTED ALKANES MERCK SHARP & DOHME CORP. 2010-07-01 — — 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-20100168076-A1 DIPHENYL SUBSTITUTED ALKANES ALOX5, ALOX15, ALOX15B ALOX5AP 14/4885LMNA 1616/4885NR1I2 332/4885

“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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