SCHEMBL2706718

SCHEMBL2706718

Pc1nc2ccccc2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.60
▸ NPC1 O15118 5/20 0.60
▸ RAB9A P51151 5/20 0.60
▸ KDM4E B2RXH2 4/20 0.60
▸ TP53 P04637 3/20 0.60
▸ PKM P14618 3/20 0.60
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ HSD17B10 Q99714 3/20 0.60
▸ NPSR1 Q6W5P4 2/20 0.60
▸ ABCB11 O95342 1/20 0.60
▸ MASP2 O00187 1/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ NUDT1 P36639 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ AOC3 Q16853 1/20 0.56
▸ GAA P10253 2/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ POLB P06746 3/20 0.50
▸ IDO1 P14902 1/20 0.50
▸ DDAH1 O94760 1/20 0.50

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
Water SCHEMBL28759430 0.98 ALDH1A1 (0.58) ALDH1A1NPC1RAB9AKDM4ETP53
SCHEMBL30561047 0.75 NPC1 (1.00) ALDH1A1NPC1RAB9AKDM4ETP53
SCHEMBL30634854 0.75 NPC1 (1.00) ALDH1A1NPC1RAB9AKDM4ETP53
SCHEMBL172216 0.75 NPC1 (1.00) ALDH1A1NPC1RAB9AKDM4ETP53
SCHEMBL29034384 0.73 ALDH1A1 (0.62) ALDH1A1NPC1RAB9AKDM4ETP53
Water SCHEMBL9817804 0.73 NPC1 (0.95) ALDH1A1NPC1RAB9AKDM4ETP53
SCHEMBL16585836 0.73 NPC1 (0.60) ALDH1A1NPC1RAB9AKDM4ETP53
SCHEMBL5924627 0.71 ALDH1A1 (0.60) ALDH1A1NPC1RAB9AKDM4ETP53
SCHEMBL460600 0.71 ALDH1A1 (0.61) ALDH1A1NPC1RAB9AKDM4ETP53
SCHEMBL277761 0.71 ALDH1A1 (0.60) ALDH1A1NPC1RAB9AKDM4ETP53

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117567519-A Benzimidazole phosphine derivative ionic platinum (II) complex with excellent red light emission and preparation method thereof 濮阳职业技术学院 2024-02-20 — — CN claimed
CN-117567518-A Efficient yellow light emitting ionic platinum complex based on benzimidazole phosphine ligand and preparation method thereof 濮阳职业技术学院 2024-02-20 — — CN claimed
CN-114591365-A Light-emitting copper compound based on benzimidazole phosphine oxide ligand and preparation method and application thereof 郑州大学 2022-06-07 — — CN claimed
CN-110330527-B Mononuclear copper complex with fluorescence property and preparation method thereof 洛阳理工学院 2022-03-29 — — CN claimed
CN-113292607-B Ionic luminescent platinum complex based on benzimidazole phosphine ligand and preparation method thereof 郑州大学 2022-02-18 — — CN claimed
CN-113292607-A Ionic luminescent platinum complex based on benzimidazole phosphine ligand and preparation method thereof 郑州大学 2021-08-24 — — CN claimed
CN-110372733-A Organic copper complex of a kind of metal with fluorescence property and preparation method thereof 郑州大学 2019-10-25 — — CN claimed
CN-110330527-A A kind of mononuclear copper complex and preparation method thereof with fluorescence property 洛阳理工学院 2019-10-15 — — CN claimed
CN-117567518-A Efficient yellow light emitting ionic platinum complex based on benzimidazole phosphine ligand and preparation method thereof 濮阳职业技术学院 2024-02-20 — — CN disclosed
CN-117567518-A Efficient yellow light emitting ionic platinum complex based on benzimidazole phosphine ligand and preparation method thereof 濮阳职业技术学院 2024-02-20 — — CN disclosed
CN-117567519-A Benzimidazole phosphine derivative ionic platinum (II) complex with excellent red light emission and preparation method thereof 濮阳职业技术学院 2024-02-20 — — CN disclosed
CN-117567519-A Benzimidazole phosphine derivative ionic platinum (II) complex with excellent red light emission and preparation method thereof 濮阳职业技术学院 2024-02-20 — — CN disclosed
CN-117567519-A Benzimidazole phosphine derivative ionic platinum (II) complex with excellent red light emission and preparation method thereof 濮阳职业技术学院 2024-02-20 — — CN disclosed
CN-117567518-A Efficient yellow light emitting ionic platinum complex based on benzimidazole phosphine ligand and preparation method thereof 濮阳职业技术学院 2024-02-20 — — CN disclosed
US-20120157404-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-06-21 — — US disclosed
US-8088368-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2012-01-03 — — US disclosed
US-8088368-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2012-01-03 — — US disclosed
US-20100310512-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2010-12-09 — — US disclosed
US-20100310512-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2010-12-09 — — US disclosed
WO-2010132601-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2010-11-18 — — 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-20120157404-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ALDH1A1 3957/4885NPC1 516/4885RAB9A 1694/4885
US-20100310512-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ALDH1A1 3957/4885NPC1 516/4885RAB9A 1694/4885

“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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