SCHEMBL21452048

SCHEMBL21452048

Cc1ccc(N(c2cccc(C(F)(F)F)c2)c2ccc3cc4c5ccc(N(c6ccc(C)cc6)c6cccc(C(F)(F)F)c6)cc5n(-c5ccccc5)c4cc3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 2/20 0.39
▸ CYP1A2 P05177 2/20 0.35
▸ TDP2 O95551 1/20 0.35
▸ PPARG P37231 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ DHFR P00374 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NOTUM Q6P988 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ KIF11 P52732 1/20 0.33
▸ GSR P00390 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
SCHEMBL21452124 0.94 MAT2A (0.39) MAT2ACYP1A2TDP2PPARGPPARA
SCHEMBL21452045 0.88 PLA2G10 (0.35) MAT2ACYP1A2PPARGPPARAMEN1
SCHEMBL21452052 0.87 DHFR (0.36) MAT2ATDP2PPARGDHFRRAB9A
SCHEMBL21452118 0.84 MAT2A (0.34) MAT2ATDP2PPARGMAPTPPARA
SCHEMBL13241935 0.84 KDM4E (0.45) MAT2APPARGPPARAMEN1KMT2A
SCHEMBL21451746 0.84 KDM4E (0.35) MAT2ACYP1A2MAPTCYP3A4CYP2C19
SCHEMBL23029181 0.83 KDM4E (0.41) MAT2ACYP1A2MAPTCYP3A4CYP2C19
SCHEMBL23029146 0.83 PLA2G10 (0.32) MAT2APPARGPPARAMEN1KMT2A
SCHEMBL21451743 0.83 ALDH1A1 (0.33) PPARGMAPTMEN1KMT2A
SCHEMBL21452024 0.82 MAT2A (0.34) MAT2ACYP1A2PPARGMAPTPPARA

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-20210057650-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2021-02-25 — — US disclosed
WO-2019194617-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2019-10-10 — — WO 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-20210057650-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME DRD1, RNF10, DRD2 MAT2A 1163/4885CYP1A2 316/4885TDP2 4201/4885

“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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