SCHEMBL13633143

SCHEMBL13633143

Cc1cc(C)n(CC(C)C(C)C)n1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.59
APAF1 O14727 1/20 0.59
POLB P06746 1/20 0.59
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 2/20 0.52
GLA P06280 1/20 0.52
GLS O94925 1/20 0.50
KMT2A Q03164 1/20 0.46
HPGD P15428 2/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL2608929 0.83 LMNA (0.62) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL24884396 0.80 LMNA (0.64) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL14578729 0.80 LMNA (0.64) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL25000882 0.78 LMNA (0.57) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL20320332 0.78 LMNA (0.56) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL3762594 0.78 KMT2A (0.64) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL18712864 0.77 LMNA (0.60) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL23616393 0.77 LMNA (0.60) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL17853363 0.77 LMNA (0.56) LMNAAPAF1POLBKDM4EALDH1A1
SCHEMBL12926035 0.76 LMNA (0.54) LMNAAPAF1POLBKDM4EALDH1A1

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-7615651-B2 Diaryl, dipyridinyl and aryl-pyridinyl derivatives and uses thereof PFIZER INC. (US) 2009-11-10 US disclosed
US-20080167371-A1 Diaryl, Dipyridinyl and Aryl-Pyridinyl Derivatives and Uses Thereof PFIZER INC. 2008-07-10 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-20080167371-A1 Diaryl, Dipyridinyl and Aryl-Pyridinyl Derivatives and Uses Thereof OPRD1, OPRK1, OPRL1 LMNA 3030/4885APAF1 3786/4885POLB 782/4885

“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.