SCHEMBL9707061

SCHEMBL9707061

C/C=C/C(=O)N1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
MAPT P10636 3/20 0.43
HPGD P15428 3/20 0.43
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 2/20 0.42

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
SCHEMBL109477 1.00 ALDH1A1 (0.43) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL25366224 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL15369081 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL13983301 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL25365258 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL25366902 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL25365949 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL24268977 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL10177866 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL11498283 0.98 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114034787-B Method for measuring sensory related amide compounds in main stream smoke of cigarettes 中国烟草总公司郑州烟草研究院 2024-05-03 CN claimed
CN-114034790-B Method for determining sensory related amide compounds in tobacco and tobacco products 中国烟草总公司郑州烟草研究院 2024-03-08 CN claimed
US-12043629-B2 RIP1K inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2024-07-23 US disclosed
CN-114034787-B Method for measuring sensory related amide compounds in main stream smoke of cigarettes 中国烟草总公司郑州烟草研究院 2024-05-03 CN disclosed
CN-114034790-B Method for determining sensory related amide compounds in tobacco and tobacco products 中国烟草总公司郑州烟草研究院 2024-03-08 CN disclosed
US-20230310454-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. 2023-10-05 US disclosed
US-20230265100-A1 RIP1K INHIBITORS RIGEL PHARMACEUTICALS, INC. 2023-08-24 US disclosed
US-20230227469-A1 RIP1K INHIBITORS RIGEL PHARMACEUTICALS, INC. 2023-07-20 US disclosed
US-11584758-B2 RIP1K inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2023-02-21 US disclosed
US-11564930-B2 RIP1 inhibitory compounds and methods for making and using the same RIGEL PHARMACEUTICALS, INC. (US) 2023-01-31 US disclosed
CN-114034787-A Method for determining sensory related amide compounds in cigarette mainstream smoke 中国烟草总公司郑州烟草研究院 2022-02-11 CN disclosed
US-9580392-B2 HIV replication inhibiting pyrimidines JANSSEN PHARMACEUTICA NV (BE) 2017-02-28 US disclosed
US-9079929-B2 Substituted tetrahydroisoquinoline compounds as factor XIa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2015-07-14 US disclosed
US-20140274960-A1 SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUNDS AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2014-09-18 US disclosed
EP-0190685-B1 HETEROCYCLIC AMIDES G.D. Searle & Co. (US) 1992-07-01 EP disclosed
US-4981853-A ANTIINFLAMMATORY AGENTS, ANTIALLERGENS G. D. SEARLE & CO. (US) 1991-01-01 US disclosed
US-4959364-A Method of treating inflammation, allergy, asthma and proliferative skin disease using heterocyclic amides G. D. SEARLE & CO. (US) 1990-09-25 US disclosed
EP-0190685-A2 Heterocyclic amides G.D. Searle & Co. (US) 1986-08-13 EP disclosed
US-4209445-A FROM PIPERONAL AND A CROTONIC AMIDE IN PRESENCE OF QUATERNARY AMMONIUM OR PHOSPHONIUM HYDROXIDE OR CROWN ETHER METAL COMPLEX HAARMAN & REIMER GMBH (DE) 1980-06-24 US disclosed
US-4209446-A FROM PIPERONAL AND A CROTONIC AMIDE IN PRESENCE OF ALKALI METAL HYDROXIDE AND DIPOLAR APROTIC DILUENT HAARMAN & REIMER GMBH (DE) 1980-06-24 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 (7 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-11584758-B2 RIP1K inhibitors RIPK1, RIPK2, RIPK3 ALDH1A1 4610/4885MAPT 1583/4885HPGD 3547/4885
US-20230310454-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIPK1, RIPK2, RIPK3 ALDH1A1 4505/4885MAPT 2246/4885HPGD 3518/4885
US-12043629-B2 RIP1K inhibitors RIPK1, RIPK2, RIPK3 ALDH1A1 4610/4885MAPT 1583/4885HPGD 3547/4885
US-20230265100-A1 RIP1K INHIBITORS RIPK1, RIPK2, RIPK3 ALDH1A1 4610/4885MAPT 1583/4885HPGD 3547/4885
US-20140274960-A1 SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUNDS AS FACTOR XIA INHIBITORS TFPI, TFPI2, KLKB1 ALDH1A1 3202/4885MAPT 4429/4885HPGD 813/4885
US-11564930-B2 RIP1 inhibitory compounds and methods for making and using the same RIPK1, RIPK2, RIPK3 ALDH1A1 4505/4885MAPT 2246/4885HPGD 3518/4885
US-20230227469-A1 RIP1K INHIBITORS RIPK1, RIPK2, RIPK3 ALDH1A1 4610/4885MAPT 1583/4885HPGD 3547/4885

“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.