SCHEMBL3625489

SCHEMBL3625489

CCC1CN(C(=O)c2ccccc2)c2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2S1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 14/20 0.48
▸ LMNA P02545 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ NR1H3 Q13133 13/20 0.45
▸ NR1I2 O75469 10/20 0.45
▸ NR1H2 P55055 9/20 0.45
▸ MAPT P10636 1/20 0.43
▸ THRB P10828 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
SCHEMBL3625482 1.00 RORC (0.48) RORCLMNAGAANR1H3NR1I2
SCHEMBL3626827 0.91 LMNA (0.48) RORCLMNAGAANR1H3NR1I2
SCHEMBL3626831 0.91 LMNA (0.48) RORCLMNAGAANR1H3NR1I2
SCHEMBL3621418 0.89 RORC (0.42) RORCLMNAGAANR1H3NR1I2
SCHEMBL3621415 0.89 RORC (0.42) RORCLMNAGAANR1H3NR1I2
SCHEMBL3625254 0.88 RORC (0.47) RORCLMNAGAANR1H3NR1I2
SCHEMBL3625249 0.88 RORC (0.47) RORCLMNAGAANR1H3NR1I2
SCHEMBL3628332 0.87 THRB (0.46) RORCLMNAGAANR1H3NR1I2
SCHEMBL3628333 0.87 THRB (0.46) RORCLMNAGAANR1H3NR1I2
SCHEMBL3615194 0.86 LMNA (0.44) RORCLMNAGAANR1H3NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2392567-B1 BENZOTHIAZINE DERIVATIVES AND THEIR USE AS LXR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2014-11-26 — — EP disclosed
EP-2392567-A1 BENZOTHIAZINE DERIVATIVES AND THEIR USE AS LXR MODULATORS Bristol-Myers Squibb Company (US) 2011-12-07 — — EP disclosed
US-7741317-B2 LXR modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-22 — — US disclosed
US-20070093470-A1 LXR modulators BRISTOL-MYERS SQUIBB COMPANY 2007-04-26 — — 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-20070093470-A1 LXR modulators NR1H2, NR1H3, RXRB RORC 66/4885LMNA 784/4885GAA 3816/4885

“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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