SCHEMBL1903551

SCHEMBL1903551

C=Cc1ccccc1C(C)N1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 6/20 0.40
LTA4H P09960 1/20 0.37
KCNA5 P22460 7/20 0.36
CYP3A4 P08684 5/20 0.36
CYP2C19 P33261 5/20 0.36
CYP1A2 P05177 4/20 0.36
CYP2C9 P11712 4/20 0.36
KCNH2 Q12809 4/20 0.36
MC4R P32245 1/20 0.36
KCNE1 P15382 2/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 2/20 0.34
SLC6A2 P23975 2/20 0.33
SLC6A3 Q01959 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9779106 0.98 CYP2D6 (0.39) CYP2D6LTA4HKCNA5CYP3A4CYP2C19
SCHEMBL9779461 0.85 KCNA5 (0.42) CYP2D6LTA4HKCNA5CYP3A4CYP2C19
SCHEMBL2464534 0.75 CYP2D6 (0.42) CYP2D6LTA4HKCNA5CYP3A4CYP2C19
SCHEMBL8983515 0.74 CYP2D6 (0.45) CYP2D6KCNA5CYP3A4CYP2C19CYP1A2
SCHEMBL10623894 0.74 CHRNA7 (0.33) CYP2D6KCNA5CYP3A4CYP2C19CYP1A2
SCHEMBL6281523 0.73 ALDH1A1 (0.44) CYP3A4CYP1A2ALDH1A1SLC6A2KMT2A
SCHEMBL29717597 0.73 GABRA1 (0.44) CYP2D6CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL29364896 0.73 ALDH1A1 (0.44) CYP3A4CYP1A2ALDH1A1SLC6A2KMT2A
SCHEMBL56243 0.73 GABRA1 (0.44) CYP2D6CYP3A4CYP2C19CYP1A2CYP2C9
SCHEMBL50011 0.73 ALDH1A1 (0.44) CYP3A4CYP1A2ALDH1A1SLC6A2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111542557-B Conjugated diene rubber 日本瑞翁株式会社 2023-03-28 CN claimed
US-20100116404-A1 TIRE WITH COMPONENT CONTAINING POLYKETONE SHORT FIBER AND FUNCTIONALIZED ELASTOMER LECHTENBOEHMER ANNETTE 2010-05-13 US claimed
EP-4159475-B1 RUBBER COMPOSITION FOR TIRE, AND TIRE YOKOHAMA RUBBER CO LTD (JP) 2025-05-21 EP disclosed
EP-4159476-B1 TIRE RUBBER COMPOSITION AND TIRE YOKOHAMA RUBBER CO LTD (JP) 2025-05-14 EP disclosed
EP-3696211-B1 MODIFIED CONJUGATED DIENE RUBBER ZEON CORP (JP) 2025-02-19 EP disclosed
CN-118055862-A Silica reinforced rubber compositions and articles made therefrom 迈图高新材料公司 2024-05-17 CN disclosed
EP-4039504-B1 RUBBER COMPOSITION AND TIRE SUMITOMO RUBBER IND (JP) 2023-10-25 EP disclosed
EP-4159476-A1 TIRE RUBBER COMPOSITION AND TIRE The Yokohama Rubber Co., Ltd. (JP) 2023-04-05 EP disclosed
EP-4159475-A1 RUBBER COMPOSITION FOR TIRE, AND TIRE The Yokohama Rubber Co., Ltd. (JP) 2023-04-05 EP disclosed
CN-111542557-B Conjugated diene rubber 日本瑞翁株式会社 2023-03-28 CN disclosed
CN-115698172-A Rubber composition for tire and tire 横滨橡胶株式会社 2023-02-03 CN disclosed
US-20040122224-A1 Functionalized monomers for synthesis of rubbery polymers THE GOODYEAR TIRE & RUBBER COMPANY 2004-06-24 US disclosed
US-20040122194-A1 Functionalized monomers for synthesis of rubbery polymers THE GOODYEAR TIRE & RUBBER COMPANY 2004-06-24 US disclosed
US-6753447-B2 REACTING SECONDARY AMINE WITH 2,3- DIHALOPROPENE TO PRODUCE A VINYL HALIDE CONTAINING CYCLIC TERTIARY AMINE; REACTING WITH VINYL MAGNESIUM HALIDE IN POLAR SOLVENT THE GOODYEAR TIRE & RUBBER COMPANY 2004-06-22 US disclosed
US-20040116635-A1 Functionalized monomers for synthesis of rubbery polymers GOODYEAR TIRE & RUBBER COMPANY, THE 2004-06-17 US disclosed
US-20040063884-A1 Functionalized monomers for synthesis of rubbery polymers THE GOODYEAR TIRE & RUBBER COMPANY 2004-04-01 US disclosed
US-20040048972-A1 Functionalized monomers for synthesis of rubbery polymers GOODYEAR TIRE & RUBBER COMPANY, THE 2004-03-11 US disclosed
US-20040044202-A1 Functionalized monomers for synthesis of rubbery polymers THE GOODYEAR TIRE & RUBBER COMPANY 2004-03-04 US disclosed
US-20040044157-A1 Functionalized monomers for synthesis of rubbery polymers GOODYEAR TIRE & RUBBER COMPANY, THE 2004-03-04 US disclosed
US-6693160-B1 FREE RADICAL COPOLYMERS OF CONJUGATED DIOLEFIN AND NITROGEN HETEROCYCLE FUNCTIONALIZED MONOMERS; LOW HYSTERESIS; FILLER COMPATIBILITY THE GOODYEAR TIRE & RUBBER COMPANY 2004-02-17 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 (3 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-20040044202-A1 Functionalized monomers for synthesis of rubbery polymers PRMT1, DDR2, DNMT3A CYP2D6 1601/4885LTA4H 2157/4885KCNA5 742/4885
US-20040063884-A1 Functionalized monomers for synthesis of rubbery polymers RDX, DPY30, RIF1 CYP2D6 3130/4885LTA4H 2816/4885KCNA5 3341/4885
US-20040122224-A1 Functionalized monomers for synthesis of rubbery polymers PRMT1, DDR2, DNMT3A CYP2D6 1601/4885LTA4H 2157/4885KCNA5 742/4885

“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.