SCHEMBL668313

SCHEMBL668313

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nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
GALR3 O60755 1/20 0.38
MAPT P10636 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PRKCA P17252 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
HPGD P15428 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL195331 0.81
SCHEMBL8223259 0.81
SCHEMBL12951628 0.81
SCHEMBL36038 0.79
SCHEMBL2153425 0.79
SCHEMBL2153285 0.79
Ether SCHEMBL22472247 0.77 TSHR (0.47) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL22486534 0.77 ALDH1A1 (0.39) TSHRCHRM1ALDH1A1LMNAHSD17B10
SCHEMBL22486478 0.77 ALDH1A1 (0.39) TSHRCHRM1ALDH1A1LMNAHSD17B10
SCHEMBL13235972 0.77 ALDH1A1 (0.39) TSHRCHRM1ALDH1A1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120045719-A1 RADIATION-SENSITIVE RESIN COMPOSITION AND COMPOUND JSR CORPORATION (JP) 2012-02-23 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-20120045719-A1 RADIATION-SENSITIVE RESIN COMPOSITION AND COMPOUND RFT1, RER1, ZYX TSHR 1148/4885CHRM2 1581/4885CHRM4 1542/4885

“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.