SCHEMBL22959151

SCHEMBL22959151

COc1ncc(Oc2c(Cl)cc(N)cc2Cl)cc1C(C)C

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.53
THRB P10828 8/20 0.41
P2RX3 P56373 4/20 0.38
P2RX2 Q9UBL9 4/20 0.38
THRA P10827 5/20 0.37
MAPT P10636 1/20 0.36
PIK3R1 P27986 1/20 0.35
PIK3CA P42336 1/20 0.35
NPBWR1 P48145 2/20 0.34
MCHR1 Q99705 2/20 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
SCHEMBL29527631 1.00 RORC (0.53) RORCTHRBP2RX3P2RX2THRA
SCHEMBL24449964 0.91 RORC (0.46) RORCTHRBP2RX3P2RX2THRA
SCHEMBL30558158 0.85 RORC (0.41) RORCTHRBP2RX3P2RX2THRA
SCHEMBL24449959 0.85 RORC (0.41) RORCTHRBP2RX3P2RX2THRA
SCHEMBL24449305 0.84 RORC (0.41) RORCP2RX3P2RX2MAPTPIK3R1
SCHEMBL24449957 0.83 RORC (0.43) RORCTHRBP2RX3P2RX2MAPT
SCHEMBL22959236 0.82 RORC (0.47) RORCTHRBP2RX3P2RX2MAPT
SCHEMBL22959061 0.81 RORC (0.51) RORCTHRBTHRAMAPT
SCHEMBL29066174 0.78 RORC (0.67) RORCTHRBTHRA
SCHEMBL29527415 0.78 RORC (0.67) RORCTHRBTHRA

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-20220162161-A1 Novel compounds and their uses as thyroid hormone receptor agonists NANJING RUIJIE PHARMA CO., LTD. (CN) 2022-05-26 US disclosed
WO-2021026179-A1 AGONISTS OF ROR GAMMAt BRISTOL-MYERS SQUIBB COMPANY (US) 2021-02-11 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-20220162161-A1 Novel compounds and their uses as thyroid hormone receptor agonists THRA, THRB, TSHR RORC 283/4885THRB 2/4885P2RX3 4031/4885

“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.