SCHEMBL2261010

SCHEMBL2261010

CC1CCN(C(=O)c2cc(C(F)(F)F)nn2-c2ccccc2Cl)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.44
RXRA P19793 3/20 0.43
NR1H2 P55055 3/20 0.43
NR1H3 Q13133 3/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ACHE P22303 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.41
TRPC3 Q13507 1/20 0.41
TRPC6 Q9Y210 1/20 0.41
TRPV1 Q8NER1 2/20 0.41
MAPT P10636 2/20 0.41
F10 P00742 1/20 0.40
CNR1 P21554 1/20 0.40
ALDH1A1 P00352 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL2257039 0.90 TRPV1 (0.42) RXRANR1H2NR1H3MEN1KMT2A
SCHEMBL12361719 0.88 ALDH1A1 (0.44) RXRANR1H2NR1H3NPC1RAB9A
SCHEMBL2256201 0.85 TSHR (0.52) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL2254796 0.85 SMN1; SMN2 (0.46) RXRANR1H2NR1H3HPGDSMN1; SMN2
SCHEMBL15706924 0.85 ABL1 (0.44) RXRANR1H2NR1H3MEN1KMT2A
SCHEMBL2257956 0.84 L3MBTL3 (0.43) RXRANR1H2NR1H3SMN1; SMN2MAPT
SCHEMBL2257175 0.83 KMT2A (0.52) RXRANR1H2NR1H3HPGDMEN1
SCHEMBL2261296 0.82 RXRA (0.46) RXRANR1H2NR1H3POLBF10
SCHEMBL2256006 0.82 CNR1 (0.58) HPGDSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL14176876 0.82 NR3C2 (0.40) RXRANR1H2NR1H3MEN1KMT2A

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 8 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
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 HSD11B1 71/4885RXRA 8/4885NR1H2 2/4885

“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.