SCHEMBL3470915

SCHEMBL3470915

CC1CCCCN1CCCNC(=O)c1ccc(-c2cc(C(F)(F)F)nn2-c2ccccc2Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 12/20 0.52
SLC2A1 P11166 1/20 0.46
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
RXRA P19793 1/20 0.45
NR1H2 P55055 1/20 0.45
NR1H3 Q13133 1/20 0.45
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
HTR3A P46098 1/20 0.43

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
SCHEMBL3474545 0.84 CHRNB2 (0.51) CACNA1GRXRANR1H2NR1H3ALDH1A1
SCHEMBL3471829 0.83 CHRNB2 (0.52) CACNA1GRXRANR1H2NR1H3ALDH1A1
SCHEMBL3473387 0.83 RXRA (0.47) RXRANR1H2NR1H3
SCHEMBL3474990 0.82 NAMPT (0.49) RAB9ARXRANR1H2NR1H3LMNA
SCHEMBL3473274 0.82 HTT (0.63) KDM4EALDH1A1
SCHEMBL3472234 0.81 ALDH1A1 (0.59) RXRANR1H2NR1H3LMNAMAPT
SCHEMBL3473364 0.81 RXRA (0.56) RXRANR1H2NR1H3LMNATP53
SCHEMBL3474824 0.81 HPGD (0.51) RAB9ANPC1RXRANR1H2NR1H3
SCHEMBL3474539 0.81 MALT1 (0.55) RXRANR1H2NR1H3LMNAMAPT
SCHEMBL3474803 0.81 RXRA (0.52) RAB9ANPC1RXRANR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8703805-B2 Modulators of LXR EXELIXIS PATENT COMPANY LLC (US) 2014-04-22 US disclosed
US-8703805-B2 Modulators of LXR EXELIXIS PATENT COMPANY LLC (US) 2014-04-22 US disclosed
US-8703805-B2 Modulators of LXR EXELIXIS PATENT COMPANY LLC (US) 2014-04-22 US disclosed
US-20100331295-A1 MODULATORS OF LXR EXELIXIS, INC. (US) 2010-12-30 US disclosed
US-20100331295-A1 MODULATORS OF LXR EXELIXIS, INC. (US) 2010-12-30 US disclosed
US-20100331295-A1 MODULATORS OF LXR EXELIXIS, INC. (US) 2010-12-30 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-20100331295-A1 MODULATORS OF LXR NR1H2, NR1H3, NR1H4 CACNA1G 3810/4885SLC2A1 1113/4885RAB9A 2024/4885

“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.