SCHEMBL2364174

SCHEMBL2364174

CC(CNC(=O)c1cc(C(F)(F)F)nn1-c1ccccc1Cl)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
CARM1 Q86X55 5/20 0.49
TDP1 Q9NUW8 1/20 0.48
TP53 P04637 2/20 0.47
P2RX7 Q99572 1/20 0.44
TRPV1 Q8NER1 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
KLKB1 P03952 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
SCHEMBL2258143 0.94 CARM1 (0.46) NPC1RAB9ACARM1TDP1P2RX7
SCHEMBL2257513 0.85 CARM1 (0.59) CARM1KLKB1
SCHEMBL2256100 0.85 CARM1 (0.59) CARM1KLKB1
SCHEMBL2256860 0.83 CARM1 (0.58) CARM1TRPV1
SCHEMBL2259763 0.82 CARM1 (0.48) CARM1KLKB1
SCHEMBL2255236 0.82 HCRTR1 (0.50) NPC1RAB9ATDP1TP53P2RX7
SCHEMBL2256640 0.82 F10 (0.49) CARM1TRPV1KLKB1
SCHEMBL14176981 0.81 CARM1 (0.41) CARM1TRPV1
SCHEMBL2262183 0.81 CARM1 (0.47) CARM1TRPV1KLKB1
SCHEMBL15706917 0.81 CARM1 (0.46) CARM1TRPV1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121621-B1 LXR AND FXR MODULATORS EXELIXIS PATENT CO LLC (US) 2014-05-07 EP disclosed
EP-2121621-B1 LXR AND FXR MODULATORS EXELIXIS PATENT CO LLC (US) 2014-05-07 EP disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-7998995-B2 LXR and FXR modulators EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-20100069367-A1 LXR and FXR Modulators EXELIXIS, INC. (US) 2010-03-18 US disclosed
US-20100069367-A1 LXR and FXR Modulators EXELIXIS, INC. (US) 2010-03-18 US disclosed
US-20100069367-A1 LXR and FXR Modulators EXELIXIS, INC. (US) 2010-03-18 US disclosed
WO-2008073825-A1 LXR AND FXR MODULATORS EXELIXIS, INC. (US) 2008-06-19 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-20100069367-A1 LXR and FXR Modulators NR1H3, NR1H2, NR1H4 NPC1 108/4885RAB9A 1352/4885CARM1 2887/4885

“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.