SCHEMBL24188637

SCHEMBL24188637

Cn1c(C(C)(C)C)cc2cc3ccsc3cc21

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 2/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ NTRK1 P04629 1/20 0.30
▸ LTK P29376 1/20 0.30
▸ TYRO3 Q06418 1/20 0.30
▸ NTRK2 Q16620 1/20 0.30
▸ CLK4 Q9HAZ1 1/20 0.30
▸ GLA P06280 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL24188606 0.78 KDM1A (0.41) KDM1A
SCHEMBL4423059 0.77 KDM1A (0.35) CYP2A6KDM1ANTRK1LTKTYRO3
SCHEMBL4417235 0.77 NTRK1 (0.39) CYP2A6KDM1ANTRK1LTKTYRO3
SCHEMBL24188612 0.74 KDM1A (0.41) KDM1ANTRK1LTKTYRO3NTRK2
SCHEMBL24188494 0.74 KDM4E (0.42) GLAGAA
SCHEMBL24188520 0.70 KDM4E (0.35) GLA
SCHEMBL17010921 0.68 CYP2A6 (0.36) CYP2A6KDM1ANTRK1LTKTYRO3
SCHEMBL13403290 0.67 GAA (0.39) CYP2A6GLAGAAL3MBTL1
SCHEMBL1041559 0.67 CYP2A6 (0.48) CYP2A6
SCHEMBL20618778 0.67 KCNH2 (0.41) GAAL3MBTL1

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-20220013735-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-01-13 — — 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-20220013735-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OXA1L, ICOSLG, ODC1 CYP2A6 3124/4885KDM1A 2675/4885NTRK1 1798/4885

“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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