SCHEMBL11920688

SCHEMBL11920688

Cc1ccc(N(C)c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ CYP2C19 P33261 1/20 0.39
▸ LMNA P02545 3/20 0.38
▸ CA12 O43570 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ CA2 P00918 1/20 0.38
▸ MCOLN3 Q8TDD5 1/20 0.38
▸ PSMB5 P28074 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ C5AR1 P21730 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ALOX12 P18054 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ HPRT1 P00492 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL6723824 0.89 TAAR1 (0.39) CES1ALDH1A1PSMB5SMN1; SMN2MEN1
SCHEMBL6723970 0.89 TAAR1 (0.39) CES1ALDH1A1PSMB5SMN1; SMN2MEN1
SCHEMBL6723985 0.89 TAAR1 (0.39) CES1ALDH1A1PSMB5SMN1; SMN2MEN1
SCHEMBL13826147 0.89 TAAR1 (0.39) CES1ALDH1A1PSMB5SMN1; SMN2MEN1
SCHEMBL6723411 0.88 PTPN1 (0.42) CES1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL27498154 0.86 PTPN1 (0.41) CES1ALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL279361 0.85 ALDH1A1 (0.41) CES1ALDH1A1CYP2C19PSMB5SMN1; SMN2
SCHEMBL20800839 0.85 CES1 (0.40) CES1ALDH1A1TSHRCYP2C19LMNA
SCHEMBL6723582 0.85 CHKA (0.41) CES1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL6780136 0.84 CES1 (0.46) CES1ALDH1A1TSHRLMNASMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11177446-B2 Silicon containing organic fluorescent materials Beijing Summer Sprout Technology Co., Ltd. (CN) 2021-11-16 — — US disclosed
US-20190081253-A1 SILICON CONTAINING ORGANIC FLUORESCENT MATERIALS Beijing Summer Sprout Technology Co., Ltd. (CN) 2019-03-14 — — US disclosed
EP-2802594-B1 METAL COMPLEXES WITH DIBENZO[F,H]QUINOXALINES UDC IRELAND LTD (IE) 2017-04-19 — — EP disclosed
EP-0891121-B1 ORGANIC ELECTROLUMINESCENT ELEMENTS TDK CORP (JP) 2012-09-26 — — EP disclosed
EP-1972619-B1 Organic compound, anthracene derivative, and light-emitting element, light-emitting device, and electronic device using anthracene derivative SEMICONDUCTOR ENERGY LAB (JP) 2012-08-15 — — EP 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 (2 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-11177446-B2 Silicon containing organic fluorescent materials ORAI2, TRPA1, IK CES1 3785/4885ALDH1A1 381/4885TSHR 4735/4885
US-20190081253-A1 SILICON CONTAINING ORGANIC FLUORESCENT MATERIALS ORAI2, TRPA1, IK CES1 3785/4885ALDH1A1 381/4885TSHR 4735/4885

“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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