SCHEMBL4094123

SCHEMBL4094123

Nc1cccc(C2=NCCN2)c1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NISCH Q9Y2I1 12/20 0.67
▸ MAOB P27338 1/20 0.61
▸ ACHE P22303 1/20 0.55
▸ FDPS P14324 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ CASP1 P29466 1/20 0.49
▸ CASP7 P55210 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49

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
SCHEMBL29446967 1.00 NISCH (0.67) NISCHMAOBACHEFDPSALDH1A1
Hydrochloric Acid SCHEMBL27888413 0.98 NISCH (0.65) NISCHMAOBACHEFDPS
Hydrochloric Acid SCHEMBL29755905 0.98 NISCH (0.65) NISCHMAOBACHEFDPS
Hydrochloric Acid SCHEMBL1143198 0.97 NISCH (0.63) NISCHMAOBACHEFDPS
SCHEMBL8195024 0.92 NISCH (0.67) NISCHMAOBFDPSALDH1A1CYP1A2
SCHEMBL7015982 0.90 NISCH (0.64) NISCHMAOBACHE
SCHEMBL9189709 0.87 NISCH (0.85) NISCHMAOBACHE
SCHEMBL8201474 0.85 NISCH (0.69) NISCHMAOB
SCHEMBL16275243 0.81 NISCH (0.60) NISCHMAOB
SCHEMBL24495491 0.80 NISCH (1.00) NISCHMAOBACHEALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116813551-A Preparation method of imidazole phenylurea dipropionate 齐鲁晟华制药有限公司 2023-09-29 — — CN claimed
CN-114773270-A Production and preparation method of imidocarb dipropionate 山东省药学科学院 2022-07-22 — — CN claimed
CN-111574455-A Preparation method of imidocarb dipropionate and intermediate thereof 山东省药学科学院 2020-08-25 — — CN claimed
CN-110256354-A A kind of imidocard dipropionate impurity A and its impurity A preparation method 齐鲁动物保健品有限公司 2019-09-20 — — CN claimed
CN-106957265-A The preparation method of 2 (3 aminophenyl) imidazoline hydrochlorides and imidazophenylurea 灌南伊斯特化工有限公司 2017-07-18 — — CN claimed
CN-102924380-A Preparation method of imidocarb QILU ANIMAL HEALTH PRODUCTS CO 2013-02-13 — — CN claimed
CN-102898375-A Preparation method of 2-(3-aminophenyl) imidazoline hydrochloride QILU ANIMAL HEALTH PRODUCTS CO 2013-01-30 — — CN claimed
CN-114671810-B Preparation method of imidazole phenylurea 济南鸿湾生物技术有限公司 2024-03-22 — — CN disclosed
CN-116813551-A Preparation method of imidazole phenylurea dipropionate 齐鲁晟华制药有限公司 2023-09-29 — — CN disclosed
CN-116621781-A Preparation method of 2- (3-nitrophenyl) -4, 5-dihydro-1H-imidazoline 济南鸿湾生物技术有限公司 2023-08-22 — — CN disclosed
CN-114773270-A Production and preparation method of imidocarb dipropionate 山东省药学科学院 2022-07-22 — — CN disclosed
CN-114671810-A Preparation method of imidocarb 济南鸿湾生物技术有限公司 2022-06-28 — — CN disclosed
CN-110950962-B Hybridoma cell strain A11S for secreting bimesomepheniul monoclonal antibody and application thereof 江南大学 2022-03-15 — — CN disclosed
WO-2009145829-A1 TYPE III SECRETION INHIBITORS, ANALOGS AND USES THEREOF UNIVERSITY OF MASSACHUSETTS (US) 2009-12-03 — — WO disclosed
US-20090194124-A1 Hair Shaping Kit and Process Comprising at Least One Non-Hydroxide Imine MALLE GERARD 2009-08-06 — — US disclosed
US-20090139537-A1 HAIR RELAXING COMPOSITION COMPRISING AT LEAST ONE NON-HYDROXIDE IMINE L'OREAL S.A. 2009-06-04 — — US disclosed
US-20050136017-A1 Cosmetic containing an imine reactive with the cystines of keratin fibers via a beta-elimination reaction to produce dehydroalanine and lead to formation of lanthionine in a medium free of polyhydroxylated alkane; guanidine and/or amidine imines such as dimethylguanidine; noncaustic for use on hair, skin L'OREAL S.A. (FR) 2005-06-23 — — US disclosed
US-20050129645-A1 Hair shaping composition comprising at least one non-hydroxide imine L'OREAL 2005-06-16 — — US disclosed
EP-1532963-A1 Composition for straightening the hair comprising at least one imine not being an hydroxide L'OREAL (FR) 2005-05-25 — — EP disclosed
EP-1532960-A1 Hair styling composition containing a non-hydroxide imine L'OREAL (FR) 2005-05-25 — — 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 (4 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-20090139537-A1 HAIR RELAXING COMPOSITION COMPRISING AT LEAST ONE NON-HYDROXIDE IMINE KRT18, INMT, INHA NISCH 153/4885MAOB 862/4885ACHE 740/4885
US-20090194124-A1 Hair Shaping Kit and Process Comprising at Least One Non-Hydroxide Imine KRT18, KIT, PRDM7 NISCH 48/4885MAOB 1998/4885ACHE 2175/4885
US-20050129645-A1 Hair shaping composition comprising at least one non-hydroxide imine KRT18, INHA, H1-5 NISCH 50/4885MAOB 2375/4885ACHE 2666/4885
US-20050136017-A1 Cosmetic containing an imine reactive with the cystines of keratin fibers via a beta-elimination reaction to produce dehydroalanine and lead to formation of lanthionine in a medium free of polyhydroxylated alkane; guanidine and/or amidine imines such as dimethylguanidine; noncaustic for use on hair, skin BHMT, KRT18, INMT NISCH 45/4885MAOB 553/4885ACHE 482/4885

“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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