SCHEMBL21607649

SCHEMBL21607649

CCOC(=O)c1cc(-c2ccc(Br)cc2OC(F)F)n(CC(C)(C)O)n1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
NR1H2 P55055 2/20 0.36
ALOX5 P09917 2/20 0.36
PTGES O14684 1/20 0.36
APAF1 O14727 1/20 0.36
SMAD3 P84022 1/20 0.36
KDM1A O60341 1/20 0.34
ELANE P08246 1/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
FAAH O00519 1/20 0.34
PTGER1 P34995 1/20 0.34

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
SCHEMBL21607426 0.90 FAAH (0.41) SMN1; SMN2ALDH1A1NR1H2ALOX5PTGES
SCHEMBL21607479 0.88 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1NR1H2ALOX5PTGES
SCHEMBL21607546 0.86 SMAD3 (0.38) RORCSMN1; SMN2ALDH1A1NR1H2ALOX5
SCHEMBL21607589 0.86 KDM1A (0.38) SMN1; SMN2ALDH1A1NR1H2ALOX5PTGES
SCHEMBL21607458 0.85 FAAH (0.41) SMN1; SMN2ALDH1A1NR1H2ALOX5PTGES
SCHEMBL21607622 0.83 ALDH1A1 (0.36) RORCSMN1; SMN2ALDH1A1NR1H2APAF1
SCHEMBL21607821 0.81 RORC (0.47) RORC
SCHEMBL21607527 0.81 NR1H2 (0.38) SMN1; SMN2ALDH1A1NR1H2APAF1SMAD3
SCHEMBL21607819 0.81 FAAH (0.42) SMN1; SMN2ALDH1A1NR1H2APAF1SMAD3
SCHEMBL21607433 0.77 FAAH (0.44) SMN1; SMN2ALDH1A1NR1H2APAF1SMAD3

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
US-10975037-B2 Phenyl substituted pyrazoles as modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2021-04-13 US disclosed
US-10975037-B2 Phenyl substituted pyrazoles as modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2021-04-13 US disclosed
CN-112566901-A Phenyl-substituted pyrazoles as modulators of ROR γ t 詹森药业有限公司 2021-03-26 CN disclosed
WO-2019243999-A1 PHENYL SUBSTITUTED PYRAZOLES AS MODULATORS OF RORYT JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 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-10975037-B2 Phenyl substituted pyrazoles as modulators of RORγt RORC, RORB, RORA RORC 1/4885SMN1; SMN2 4508/4885ALDH1A1 801/4885

“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.