SCHEMBL19087611

SCHEMBL19087611

Cc1ccccc1Nc1cc(C(C)(C)C)ccc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAS2R14 Q9NYV8 1/20 0.50
▸ TP53 P04637 1/20 0.45
▸ SLC2A1 P11166 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ CCR4 P51679 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ P2RX7 Q99572 2/20 0.42
▸ PPARG P37231 1/20 0.42
▸ MAPK10 P53779 1/20 0.41
▸ KMT2A Q03164 3/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ NTSR1 P30989 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
SCHEMBL19087403 0.83 RAPGEF4 (0.53) TAS2R14TP53ALDH1A1KMT2AMEN1
SCHEMBL24255017 0.83 TAS2R14 (0.41) TAS2R14ALDH1A1LMNAP2RX7PPARG
SCHEMBL22743371 0.83 HSD17B2 (0.46) TAS2R14ALDH1A1LMNAP2RX7PPARG
SCHEMBL19087556 0.82 RAPGEF4 (0.50) TAS2R14TP53ALDH1A1LMNASMN1; SMN2
SCHEMBL23927543 0.80 CSNK1D (0.47) ALDH1A1LMNAKMT2AMEN1TDP1
SCHEMBL30719048 0.80 CSNK1D (0.47) ALDH1A1LMNAKMT2AMEN1TDP1
SCHEMBL4901952 0.79 P2RX7 (0.46) TP53SLC2A1ALDH1A1CCR4SMN1; SMN2
SCHEMBL12320144 0.79 CSNK1D (0.39) TAS2R14TP53SLC2A1ALDH1A1LMNA
SCHEMBL24318836 0.78 P2RX7 (0.45) TP53SLC2A1ALDH1A1CCR4SMN1; SMN2
SCHEMBL12320134 0.77 GAA (0.45) TP53SLC2A1ALDH1A1SMN1; SMN2P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110249030-B Organic electroluminescent device 材料科学有限公司 2023-04-18 — — CN disclosed
US-20200377513-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2020-12-03 — — US disclosed
US-20200377513-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2020-12-03 — — US disclosed
US-20190006592-A1 NOVEL ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME MATERIAL SCIENCE CO., LTD. (KR) 2019-01-03 — — US disclosed
WO-2018128470-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 머티어리얼사이언스 주식회사 2018-07-12 — — WO disclosed
EP-2635274-B1 ANTI-STAPHYLOCOCCAL CELECOXIB DERIVATIVES UNIV OHIO STATE RES FOUND (US) 2017-12-06 — — EP disclosed
WO-2017116169-A1 NOVEL ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 머티어리얼사이언스 주식회사 2017-07-06 — — 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 (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-20190006592-A1 NOVEL ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME OCIAD1, OCIAD2, ORC3 TAS2R14 2750/4885TP53 1330/4885SLC2A1 4641/4885
US-20200377513-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE PIEZO1, TMEM109, LEF1 TAS2R14 1401/4885TP53 4575/4885SLC2A1 2517/4885

“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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