SCHEMBL2262678

SCHEMBL2262678

Cc1ccc(NC(=O)COc2cc(C(F)(F)F)nn2-c2ccccc2Cl)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.46
▸ NPC1 O15118 3/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ TGFBR1 P36897 1/20 0.44
▸ HPGD P15428 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ P2RY1 P47900 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ POLB P06746 1/20 0.41

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
SCHEMBL2259440 0.93 TGFBR1 (0.44) RAB9ANPC1MEN1KMT2ATGFBR1
SCHEMBL2257923 0.92 HPGD (0.47) RAB9ANPC1MEN1KMT2ATGFBR1
SCHEMBL15707237 0.92 ALDH1A1 (0.43) MEN1KMT2ATGFBR1HPGDMAPT
SCHEMBL2256598 0.91 DVL1 (0.42) MEN1KMT2ATGFBR1HPGDALDH1A1
SCHEMBL14177255 0.91 GAA (0.48) RAB9ANPC1MEN1KMT2ATGFBR1
SCHEMBL2257831 0.91 TGFBR1 (0.42) RAB9AKMT2ATGFBR1HPGDMAPT
SCHEMBL15706879 0.90 RAB9A (0.49) RAB9ANPC1MEN1KMT2ATGFBR1
SCHEMBL2256917 0.90 ALDH1A1 (0.45) RAB9ANPC1KMT2ATGFBR1HPGD
SCHEMBL2254861 0.89 TRPM4 (0.46) MEN1KMT2ATGFBR1HPGDMAPT
SCHEMBL2259796 0.89 TP53 (0.47) RAB9AMEN1KMT2AHPGDMAPT

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 RAB9A 1352/4885NPC1 108/4885MEN1 3422/4885

“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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