SCHEMBL20139668

SCHEMBL20139668

Fc1cccc(F)c1-c1ccc([C@@H]2CNC[C@H]2Cc2cccc3ccccc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 8/20 0.59
CYP2D6 P10635 1/20 0.41
HPGD P15428 2/20 0.38
ATM Q13315 1/20 0.38
IDE P14735 1/20 0.36
UBE2N P61088 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
KCNH2 Q12809 1/20 0.35
KMT2A Q03164 2/20 0.35
TAAR1 Q96RJ0 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL23683598 1.00 RORC (0.59) RORCCYP2D6HPGDATMIDE
SCHEMBL23683613 1.00 RORC (0.59) RORCCYP2D6HPGDATMIDE
SCHEMBL20139727 0.87 RORC (0.46) RORCCYP2D6HPGDATMIDE
SCHEMBL20139666 0.87 RORC (0.46) RORCCYP2D6HPGDATMIDE
SCHEMBL20149049 0.81 RORC (0.56) RORC
SCHEMBL23683586 0.81 RORC (0.56) RORC
Hydrochloric Acid SCHEMBL23683617 0.80 RORC (0.55) RORC
Hydrochloric Acid SCHEMBL23683618 0.80 RORC (0.55) RORC
SCHEMBL20139695 0.78 RORC (0.60) RORCCYP2D6IDEUBE2N
SCHEMBL23683609 0.77 RORC (0.60) RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11078186-B2 ROR γ modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2021-08-03 US disclosed
US-11078186-B2 ROR γ modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2021-08-03 US disclosed
EP-3538522-A1 ROR GAMMA MODULATORS Bristol-Myers Squibb Company (US) 2019-09-18 EP disclosed
WO-2018089406-A1 ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-17 WO disclosed
WO-2018089406-A1 ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-17 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-11078186-B2 ROR γ modulators RORB, RORC, RORA RORC 2/4885CYP2D6 425/4885HPGD 1306/4885

“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.