SCHEMBL24003242

SCHEMBL24003242

Cc1cccc2c1sc1c(O)nnnc12

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ PARP15 Q460N3 1/20 0.33
▸ PARP10 Q53GL7 1/20 0.33
▸ TNKS2 Q9H2K2 1/20 0.33
▸ PARP2 Q9UGN5 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ MAPT P10636 2/20 0.31
▸ HCRTR1 O43613 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ SLC6A2 P23975 1/20 0.30
▸ HTT P42858 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
SCHEMBL22627733 0.77 LIMK1 (0.41) CYP1A2CYP2A6ALDH1A1MAPTSLC6A2
SCHEMBL11488952 0.75 LIMK1 (0.44) TNKS2ALDH1A1MAPTHCRTR1LMNA
SCHEMBL29364650 0.72 CYP1A2 (0.55) CYP1A2CYP2A6PARP15PARP10TNKS2
SCHEMBL142551 0.72 CYP1A2 (0.55) CYP1A2CYP2A6PARP15PARP10TNKS2
SCHEMBL24003251 0.71 CYP1A2 (0.46) CYP1A2CYP2A6TNKS2ALDH1A1SLC6A2
Hydrogen Sulfide SCHEMBL28590036 0.70 CYP1A2 (0.52) CYP1A2CYP2A6PARP15PARP10TNKS2
SCHEMBL22627556 0.70 HTR1A (0.36) CYP1A2CYP2A6PARP15PARP10TNKS2
SCHEMBL24003252 0.70 PIM1 (0.40) PARP15PARP10TNKS2PARP2ALDH1A1
SCHEMBL24343664 0.70 TRPA1 (0.46) CYP1A2CYP2A6PARP15TNKS2PARP2
SCHEMBL19039387 0.69 PSMD14 (0.49) CYP1A2CYP2A6ALDH1A1MAPTPOLB

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-20210347797-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2021-11-11 — — 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-20210347797-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, TPO CYP1A2 369/4885CYP2A6 3778/4885PARP15 1565/4885

“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.

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