SCHEMBL23430898

SCHEMBL23430898

COc1cc(C)ccc1-n1cc(-c2ccc(O)c(O)c2)nn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 2/20 0.54
▸ MAPT P10636 1/20 0.54
▸ RAC1 P63000 2/20 0.43
▸ GFER P55789 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ CASP6 P55212 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ GAA P10253 2/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PSEN1 P49768 4/20 0.40
▸ PSEN2 P49810 4/20 0.40
▸ APH1B Q8WW43 4/20 0.40
▸ NCSTN Q92542 4/20 0.40
▸ APH1A Q96BI3 4/20 0.40
▸ PSENEN Q9NZ42 4/20 0.40
▸ CYP1B1 Q16678 1/20 0.40
▸ ESRRG P62508 1/20 0.40
▸ STIM1 Q13586 1/20 0.39

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
SCHEMBL23405498 0.88 MAPT (0.54) SNCAMAPTRAC1POLBPKM
SCHEMBL23405475 0.75 MAPT (0.67) SNCAMAPTNPC1CYP1B1STIM1
SCHEMBL23405471 0.74 SNCA (0.62) SNCAMAPTGFERNPC1POLB
SCHEMBL22340587 0.74 BCHE (0.49) NPC1KMT2ACA1CA2CA5A
SCHEMBL23405493 0.72 SNCA (0.59) SNCAMAPTGFERPOLBPKM
SCHEMBL12682333 0.71 SNCA (1.00) SNCAMAPTCYP1B1ESRRGCA1
SCHEMBL23405476 0.71 MAPT (0.81) SNCAMAPTGFERNPC1POLB
SCHEMBL23405500 0.70 SNCA (0.61) SNCAMAPTGFERGAAKMT2A
SCHEMBL26628340 0.70 STIM1 (0.67) SNCASTIM1ORAI1
SCHEMBL23405495 0.69 MAPT (0.82) SNCAMAPTESRRGCA1CA2

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-20210163425-A1 TRIAZOLE DERIVATIVE AND USE THEREOF GYEONGGIDO BUSINESS & SCIENCE ACCELERATOR (KR) 2021-06-03 — — 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-20210163425-A1 TRIAZOLE DERIVATIVE AND USE THEREOF FABP4, LIPC, GPR119 SNCA 4775/4885MAPT 2951/4885RAC1 4158/4885

“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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