SCHEMBL801453

SCHEMBL801453

CC(C)(C)c1ccc(-c2cccc(-n3c4ccc(P(=O)(c5ccccc5)c5ccccc5)cc4c4cc(P(=O)(c5ccccc5)c5ccccc5)ccc43)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.37
▸ SERPINE1 P05121 3/20 0.37
▸ DHODH Q02127 1/20 0.37
▸ RXRA P19793 1/20 0.36
▸ RXRB P28702 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ HSD17B2 P37059 1/20 0.35
▸ MAP3K5 Q99683 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ PPARG P37231 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ PTGES O14684 1/20 0.35
▸ ASIC1 P78348 1/20 0.34
▸ OPRD1 P41143 1/20 0.34
▸ FAAH O00519 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ PKM P14618 1/20 0.34

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
SCHEMBL801148 0.97 PPARG (0.37) CYP19A1SERPINE1DHODHRXRARXRB
SCHEMBL801152 0.88 PTPN5 (0.39) CYP19A1LMNAALDH1A1NPSR1MAPT
SCHEMBL801114 0.88 ATM (0.44) RXRARXRBALDH1A1NPSR1MAPT
SCHEMBL801164 0.87 PPARG (0.41) RXRALMNANPSR1PPARGMAPT
SCHEMBL801721 0.87 PPARG (0.42) CYP19A1SERPINE1ALDH1A1NPSR1PPARG
SCHEMBL801335 0.85 PPARG (0.39) RXRALMNANPSR1PPARGMAPT
SCHEMBL801451 0.85 ATM (0.44) ALDH1A1NPSR1MAPTMAPK1FAAH
SCHEMBL801604 0.85 PPARG (0.38) LMNANPSR1PPARGMAPTATM
SCHEMBL801452 0.85 NPSR1 (0.41) LMNAALDH1A1NPSR1MAPTFAAH
SCHEMBL14464646 0.85 RXRA (0.43) SERPINE1DHODHRXRARXRBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9278986-B2 Carbazole-based phosphine oxide compound, and organic electroluminescent device including the same SK CHEMICALS CO., LTD. (KR) 2016-03-08 — — US disclosed
US-9278986-B2 Carbazole-based phosphine oxide compound, and organic electroluminescent device including the same SK CHEMICALS CO., LTD. (KR) 2016-03-08 — — US disclosed
US-20120068168-A1 CARBAZOLE-BASED PHOSPHINE OXIDE COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME INDUSTRY-ACADEMIC COOPERATION FOUNDATION, DANKOOK UNIVERSITY (KR) 2012-03-22 — — US disclosed
US-20120068168-A1 CARBAZOLE-BASED PHOSPHINE OXIDE COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME INDUSTRY-ACADEMIC COOPERATION FOUNDATION, DANKOOK UNIVERSITY (KR) 2012-03-22 — — 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-20120068168-A1 CARBAZOLE-BASED PHOSPHINE OXIDE COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME INPP5B, EZH2, PLCB3 CYP19A1 2737/4885SERPINE1 4237/4885DHODH 1003/4885

“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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