SCHEMBL25616698

SCHEMBL25616698

COc1cc(C(O)C(=O)c2ccc(SC)cc2)ccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TSHR P16473 1/20 0.43
GAA P10253 1/20 0.39
ALOX5 P09917 2/20 0.39
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 2/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL25616696 0.92 MAPT (0.40) BLMNPSR1TSHRGAAALOX5
SCHEMBL24054984 0.89 ALOX5 (0.48) BLMNPSR1TSHRGAAALOX5
SCHEMBL25616787 0.86 NPSR1 (0.47) BLMNPSR1TSHRCES2CES1
SCHEMBL25616779 0.86 TSHR (0.49) BLMNPSR1TSHRCES2CES1
SCHEMBL25616695 0.84 NPSR1 (0.44) BLMNPSR1TSHRCES2CES1
SCHEMBL25616701 0.84 CES2 (0.47) BLMNPSR1TSHRGAACES2
SCHEMBL8138571 0.83 CES2 (0.50) BLMNPSR1TSHRGAAALOX5
SCHEMBL25616690 0.82 TSHR (0.50) BLMNPSR1TSHRGAACES2
SCHEMBL25616875 0.81 CYP1A2 (0.49) TSHRGAAALOX5MAPTSMN1; SMN2
SCHEMBL11186384 0.80 CES2 (0.53) BLMNPSR1TSHRGAACES2

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-20230183167-A1 VISIBLE LIGHT ACTIVE BIOMASS DERIVED PHOTOINITIATORS BOWLING GREEN STATE UNIVERSITY (US) 2023-06-15 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-20230183167-A1 VISIBLE LIGHT ACTIVE BIOMASS DERIVED PHOTOINITIATORS BLVRB, GLB1, BTD BLM 194/4885NPSR1 3869/4885TSHR 4759/4885

“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.