SCHEMBL25782693

SCHEMBL25782693

CC(C)(C)c1ccc2cnnnc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 5/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ HRH4 Q9H3N8 2/20 0.33
▸ HRH3 Q9Y5N1 2/20 0.33
▸ TSHR P16473 1/20 0.32
▸ METAP2 P50579 1/20 0.32
▸ NPC1 O15118 3/20 0.32
▸ RAB9A P51151 2/20 0.32

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
SCHEMBL22292142 0.87 SCN10A (0.39) SCN10AKCNH2ALDH1A1HPGDALOX15
SCHEMBL13438759 0.77 SCN10A (0.37) SCN10AKCNH2ALDH1A1HPGDALOX15
SCHEMBL2229798 0.75 ALDH1A1 (0.41) SCN10AKCNH2ALDH1A1HPGDALOX15
SCHEMBL21672220 0.75 ALDH1A1 (0.41) SCN10AKCNH2ALDH1A1HPGDALOX15
SCHEMBL21512319 0.74 CYP1A2 (0.48) ALDH1A1HPGDHSD17B10TDP1KMT2A
SCHEMBL4548624 0.73 TSHR (0.37) SCN10AKCNH2ALDH1A1HPGDALOX15
SCHEMBL14427134 0.73 TERT (0.46) SCN10AKCNH2ALDH1A1HPGDALOX15
SCHEMBL9922346 0.72 EGFR (0.55) SCN10AKCNH2ALDH1A1HPGDALOX15
SCHEMBL1695518 0.71 TRPV1 (0.40) SCN10AKCNH2ALDH1A1HPGDALOX15
SCHEMBL12227509 0.70 NR1I2 (0.36) SCN10AKCNH2ALDH1A1HPGDALOX15

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-11700768-B2 Compound and organic light emitting device comprising the same LG CHEM, LTD. (KR) 2023-07-11 — — US disclosed
US-11700768-B2 Compound and organic light emitting device comprising the same LG CHEM, LTD. (KR) 2023-07-11 — — 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-11700768-B2 Compound and organic light emitting device comprising the same ARL1, ARRB1, CRY1 SCN10A 3441/4885KCNH2 1598/4885ALDH1A1 1070/4885

“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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