SCHEMBL4268344

SCHEMBL4268344

CCN(CC)c1ccc2ccccc2n1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NCF1 P14598 3/20 0.62
▸ PTK2 Q05397 1/20 0.51
▸ CYP1A2 P05177 3/20 0.47
▸ ELANE P08246 1/20 0.44
▸ LMNA P02545 2/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ MYC P01106 1/20 0.42
▸ BCHE P06276 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ NOS2 P35228 1/20 0.42
▸ BACE1 P56817 1/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ TERT O14746 2/20 0.41
▸ ACP1 P24666 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL13701721 0.86 NCF1 (0.60) NCF1PTK2CYP1A2ELANELMNA
SCHEMBL31019195 0.85 NCF1 (0.50) NCF1PTK2CYP1A2ELANEMYC
SCHEMBL13371376 0.84 NCF1 (0.62) NCF1PTK2CYP1A2LMNACYP2C19
SCHEMBL25488411 0.83 NCF1 (0.56) NCF1PTK2CYP1A2ELANELMNA
SCHEMBL27778508 0.82 NCF1 (0.47) NCF1PTK2CYP1A2ELANELMNA
SCHEMBL27944767 0.77 PTK2 (0.60) NCF1PTK2CYP1A2LMNACYP2C19
SCHEMBL6071316 0.77 CYP1A2 (0.50) NCF1PTK2CYP1A2CYP2D6CYP2C19
SCHEMBL31650826 0.77 NCF1 (1.00) NCF1PTK2CYP1A2LMNAACHE
SCHEMBL29946313 0.77 NCF1 (1.00) NCF1PTK2CYP1A2LMNAACHE
SCHEMBL12383278 0.77 NCF1 (0.76) NCF1PTK2CYP1A2LMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023088620-A1 CYCLIC BIARYL PHOSPHINES AS LIGANDS FOR PALLADIUM-CONTAINING CATALYSTS IN CROSS-COUPLING REACTIONS Heraeus Deutschland GmbH & Co. KG (DE) 2023-05-25 — — WO disclosed
EP-4180440-A1 CYCLIC BIARYLPHOSPHINES AS LIGANDS FOR PALLADIUM-CONTAINING CATALYSTS IN CROSS-COUPLING REACTIONS Heraeus Deutschland GmbH & Co. KG (DE) 2023-05-17 — — EP disclosed
CN-108299293-A Colorimetric-fluorescent probe compounds of cyanide/hydrogen cyanide and preparation method thereof 中国科学技术大学 2018-07-20 — — CN disclosed
US-7605215-B2 Process for producing olefin copolymerization catalyst and process for producing olefin copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-20 — — US disclosed
US-20090226411-A1 CHEMICAL DERIVATIVES AND THEIR APPLICATION AS ANTITELOMERASE AGENTS AVENTIS PHARMA S.A. (FR) 2009-09-10 — — US disclosed
US-7482352-B2 Chemical derivatives and their application as antitelomerase agents AVENTIS PHARMA S.A. (FR) 2009-01-27 — — US disclosed
US-20080227937-A1 Process for Producing Olefin Copolymerization Catalyst and Process for Producing Olefin Copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-18 — — US disclosed
US-5405843-A Anticancer drug potentiators MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-04-11 — — US disclosed
EP-0363212-B1 Novel heterocyclic compounds and anticancer-drug reinforcing agents containing them as effective components MITSUI TOATSU CHEMICALS (JP) 1995-01-04 — — EP disclosed
US-5204348-A Quinoline derivatives MITSUI TOATSU CHEMICALS INC. (JP) 1993-04-20 — — US disclosed
US-5112817-A Anticancer Drug Potentiators MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1992-05-12 — — US disclosed
EP-0363212-A2 Novel heterocyclic compounds and anticancer-drug reinforcing agents containing them as effective components MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-04-11 — — 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 (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-20090226411-A1 CHEMICAL DERIVATIVES AND THEIR APPLICATION AS ANTITELOMERASE AGENTS DPYD, NTPCR, NME1 NCF1 1011/4885PTK2 1590/4885CYP1A2 1561/4885

“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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