SCHEMBL29293128

SCHEMBL29293128

Cc1cc(-c2ccc(-c3ccc(-c4cccc5c4sc4c(-c6ccc(-c7ccc(-c8cc(C)cc(C(F)(F)F)c8)nc7)cc6)cccc45)cc3)cn2)cc(C(F)(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 4/20 0.36
▸ ENPP1 P22413 2/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ DHODH Q02127 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ ALOX5AP P20292 3/20 0.33
▸ FEN1 P39748 3/20 0.33
▸ CLK1 P49759 1/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ PIM1 P11309 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ BACE2 Q9Y5Z0 1/20 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
SCHEMBL29294002 0.92 KDM1A (0.41) KDM1AMAOBALOX5APFEN1CLK1
SCHEMBL29292919 0.84 NOTUM (0.36) KDM1AENPP1NPC1CYP1A2CYP3A4
SCHEMBL29293114 0.83 KDR (0.42) ENPP1NPC1MAPTCYP11B1CYP11B2
SCHEMBL29293116 0.83 KDR (0.42) ENPP1NPC1MAPTCYP11B1CYP11B2
SCHEMBL29293126 0.82 HSD17B1 (0.35) ALOX5APFEN1BACE1BACE2
SCHEMBL29293210 0.78 KDR (0.41) ENPP1NPC1MAPTCYP11B1CYP11B2
SCHEMBL29294005 0.76 ALOX5AP (0.42) KDM1ACYP1A2CYP3A4CYP2C19MAOB
SCHEMBL26559741 0.76 ALOX5 (0.34) ENPP1
SCHEMBL26551285 0.76 ENPP1 (0.35) ENPP1MAPTMAOBCLK1ALDH1A1
SCHEMBL29293133 0.75 LIMK1 (0.49) CYP1A2CYP11B1CYP11B2

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-20240228470-A1 Organic Compound And Organic Light Emitting Device Including Same P&H TECH CO., LTD (KR) 2024-07-11 — — 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-20240228470-A1 Organic Compound And Organic Light Emitting Device Including Same OR10J3, ORMDL3, OR51E2 KDM1A 1854/4885ENPP1 2585/4885NPC1 1172/4885

“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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