SCHEMBL18156927

SCHEMBL18156927

CC(O)(c1ccc(NC(=O)Cc2cccc(S(=O)(=O)NCC3CC3)c2)cc1)C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.48
PDK2 Q15119 1/20 0.48
PDK3 Q15120 1/20 0.48
PDK4 Q16654 1/20 0.48
TGFBR1 P36897 6/20 0.48
POLB P06746 3/20 0.45
RECQL P46063 1/20 0.45
RORC P51449 1/20 0.44
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 2/20 0.42
TP53 P04637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
IDH2 P48735 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
SCHEMBL18151622 0.91 RORC (0.53) PDK1PDK2PDK3PDK4TGFBR1
SCHEMBL18156908 0.88 TSHR (0.53) POLBRECQLRORCALDH1A1LMNA
SCHEMBL18156907 0.87 RORC (0.47) PDK1PDK2PDK3PDK4POLB
SCHEMBL18156912 0.85 RORC (0.49) POLBRECQLRORCALDH1A1LMNA
SCHEMBL18156917 0.85 MAPT (0.47) PDK1PDK2PDK3PDK4POLB
SCHEMBL18156909 0.81 KCNJ6 (0.53) RORCALDH1A1LMNAMEN1KMT2A
SCHEMBL18151715 0.79 RORC (0.65) PDK1PDK2PDK3PDK4RORC
SCHEMBL18151641 0.79 RORC (0.62) POLBRECQLRORCALDH1A1LMNA
SCHEMBL16799539 0.77 RORC (0.63) RORC
SCHEMBL18151519 0.77 RORC (0.54) RORCALDH1A1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9738600-B2 ROR gamma (RORγ) modulators LEAD PHARMA CEL MODELS IP B.V. (NL) 2017-08-22 US disclosed
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS LEAD PHARMA CEL MODELS IP B.V. (NL) 2016-10-20 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-20160304448-A1 ROR GAMMA (RORy) MODULATORS RORC, RORA, RORB PDK1 3903/4885PDK2 4057/4885PDK3 3755/4885

“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.