SCHEMBL1149909

SCHEMBL1149909

CCN=C=NC(N)CC(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
ANPEP P15144 1/20 0.30
ERAP2 Q6P179 1/20 0.30
ERAP1 Q9NZ08 1/20 0.30

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
Hydrochloric Acid SCHEMBL7115792 0.98 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1
Hydrochloric Acid SCHEMBL2515578 0.98 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1
SCHEMBL1443231 0.79
Hydrochloric Acid SCHEMBL8103830 0.77 CYP1A2 (0.30)
Hydrochloric Acid SCHEMBL5703513 0.74
SCHEMBL4429218 0.74 ALDH1A1 (0.35) ALDH1A1TSHRMAPK1
Hydrochloric Acid SCHEMBL7429668 0.72
Hydrochloric Acid SCHEMBL5338641 0.72 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1
SCHEMBL7484113 0.71
Hydrochloric Acid SCHEMBL4275672 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315669-B Methionine amide type small molecule lubricating oil additive and synthetic method and application thereof 大连理工大学宁波研究院 2023-12-22 CN claimed
CN-115677727-B Synthesis method of ceftazidime sulfate 齐鲁安替制药有限公司 2023-11-24 CN claimed
CN-111995605-B Chrysin cinnamate or its derivative and its preparation method 五邑大学 2023-02-17 CN claimed
CN-115677727-A Synthesis method of ceftaroline fosamil sulfate 齐鲁安替制药有限公司 2023-02-03 CN claimed
CN-111233770-B Chiral pyrazole derivative and synthesis method thereof 南通大学 2022-12-27 CN claimed
EP-4043447-A1 HALOGENATED TETRACYCLIC TRITERPENE DERIVATIVE, PREPARATION AND APPLICATION THEREOF Shanghai King-X Biotech Co., Ltd. (CN) 2022-08-17 EP claimed
US-20220177511-A1 SERIES OF HALOGENATED TETRACYCLIC TRITERPENE DERIVATIVES AND THEIR PREPARATION AND APPLICATION Shanghai Qingdong Biotechnology Co., Ltd. (CN) 2022-06-09 US claimed
CN-114315669-A Methionine amide micromolecule lubricating oil additive and synthetic method and application thereof 大连理工大学宁波研究院 2022-04-12 CN claimed
CN-113416197-B Carboxamide derivative, preparation method, pharmaceutical composition and application 北京鑫开元医药科技有限公司 2021-12-28 CN claimed
CN-111249461-A Preparation and application of phycocyanin-chlorin e6 covalent nanoparticles 福州大学 2020-06-09 CN claimed
US-9359372-B2 Hexahydrodibenzo[a,g]quinolizine compound, preparation method thereof, pharmaceutical composition and use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2016-06-07 US claimed
US-20150210711-A1 HEXAHYDRODIBENZO[A,G]QUINOLIZINE COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI INST MATERIA MEDICA (CN) 2015-07-30 US claimed
US-20140088130-A1 HEXAHYDRODIBENZO[A,G]QUINOLIZINE COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2014-03-27 US claimed
US-20130039904-A1 GAMBOGIC ACID CYCLIZATION ANALOGUES, THEIR PREPARATION METHOD AND APPLICATION THEREOF LIAONING LIFENG SCIENTIFIC & TECHNOLOGY DEVELOPMENT COMPANY LTD. (CN) 2013-02-14 US claimed
US-20240182465-A1 FUSED RING SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2024-06-06 US disclosed
US-20240166664-A1 TRIHETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF SHANGHAI APEIRON THERAPEUTICS COMPANY LIMITED (CN) 2024-05-23 US disclosed
EP-4303216-A1 FUSED RING SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Genfleet Therapeutics (Shanghai) Inc. (CN) 2024-01-10 EP disclosed
WO-2002070544-A2 METHODS, COMPOSITIONS AND KITS FOR PRESERVING ANTIGENICITY IDUN PHARMACEUTICALS, INC. (US) 2002-09-12 WO disclosed
EP-0230166-A1 Diagnostic reagents INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1987-07-29 EP disclosed
WO-1987003372-A1 DIAGNOSIS REAGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE M (FR) 1987-06-04 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 (6 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-20140088130-A1 HEXAHYDRODIBENZO[A,G]QUINOLIZINE COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF HTR5A, HTR1A, HTR2C ALDH1A1 1083/4885TSHR 233/4885MAPK1 1862/4885
US-20130039904-A1 GAMBOGIC ACID CYCLIZATION ANALOGUES, THEIR PREPARATION METHOD AND APPLICATION THEREOF IFNG, OXGR1, TLR7 ALDH1A1 3646/4885TSHR 1715/4885MAPK1 3091/4885
US-20220177511-A1 SERIES OF HALOGENATED TETRACYCLIC TRITERPENE DERIVATIVES AND THEIR PREPARATION AND APPLICATION AGTR1, VIP, AGT ALDH1A1 292/4885TSHR 45/4885MAPK1 1657/4885
US-20150210711-A1 HEXAHYDRODIBENZO[A,G]QUINOLIZINE COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF HTR5A, HTR1A, HTR2C ALDH1A1 1083/4885TSHR 233/4885MAPK1 1862/4885
US-20240166664-A1 TRIHETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, WEE1, WEE2 ALDH1A1 1500/4885TSHR 3151/4885MAPK1 1049/4885
US-20240182465-A1 FUSED RING SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, WEE2, HASPIN ALDH1A1 3571/4885TSHR 4703/4885MAPK1 300/4885

“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.