SCHEMBL97001

SCHEMBL97001

CC(=O)NCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.68
PTPN1 P18031 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.60
CYP2C9 P11712 2/20 0.59
GAA P10253 1/20 0.59
HDAC1 Q13547 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
MEN1 O00255 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2D6 P10635 1/20 0.57
TSHR P16473 1/20 0.57
CYP2C19 P33261 1/20 0.57
ALDH1A1 P00352 4/20 0.56
MAPT P10636 2/20 0.56
POLB P06746 1/20 0.56
RAB9A P51151 1/20 0.56
RIPK1 Q13546 1/20 0.56
HPGD P15428 1/20 0.56
ALOX12 P18054 1/20 0.56
CA12 O43570 1/20 0.56

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
Bromide SCHEMBL30703423 0.98 KMT2A (0.66) KMT2APTPN1SMN1; SMN2CYP2C9GAA
Hydrochloric Acid SCHEMBL27905582 0.98 KMT2A (0.66) KMT2APTPN1SMN1; SMN2CYP2C9GAA
Acetic Acid SCHEMBL10568555 0.98 KMT2A (0.66) KMT2APTPN1SMN1; SMN2CYP2C9GAA
Cyclopropane SCHEMBL6695009 0.94 KMT2A (0.61) KMT2APTPN1SMN1; SMN2CYP2C9GAA
SCHEMBL21758204 0.94 KMT2A (0.61) KMT2APTPN1SMN1; SMN2CYP2C9GAA
SCHEMBL3323001 0.94 KMT2A (0.61) KMT2APTPN1SMN1; SMN2CYP2C9GAA
Toluene SCHEMBL29122543 0.92 SMN1; SMN2 (0.68) KMT2APTPN1SMN1; SMN2CYP2C9GAA
Ethylenediamine SCHEMBL4062109 0.92 KIF11 (0.60) KMT2APTPN1SMN1; SMN2CYP2C9GAA
N-Benzylmethylamine SCHEMBL2561295 0.92 MAPT (0.63) KMT2APTPN1SMN1; SMN2CYP2C9GAA
SCHEMBL28286652 0.90 KMT2A (0.58) KMT2APTPN1SMN1; SMN2CYP2C9GAA

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

Appears in 2127 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4399212-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-07-17 EP claimed
CN-118159542-A Substituted 2, 3-dihydro [1,3] thiazolo [4,5-b ] pyridines, salts thereof and their use as herbicidal agents 拜耳公司 2024-06-07 CN claimed
CN-115745838-B Method for synthesizing amidine compound and N-benzyl acetamidine hydrochloride 苏州诚和医药化学有限公司 2023-12-22 CN claimed
CN-116234546-A GPX4 inhibitors, pharmaceutical compositions thereof and their use in the treatment of GPX4 mediated diseases 嘉兴优博生物技术有限公司 2023-06-06 CN claimed
US-20230131260-A1 SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 US claimed
WO-2023036707-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2023-03-16 WO claimed
CN-115745838-A Synthetic method of amidine compound and N-benzyl acetamidine hydrochloride 苏州诚和医药化学有限公司 2023-03-07 CN claimed
CN-115521507-A Hyaluronic acid supermolecule hydrogel and preparation method and application thereof 清华大学 2022-12-27 CN claimed
CN-111187176-B Method for preparing N-vinyl amide compound under catalysis of copper salt 浙江工业大学 2022-11-25 CN claimed
US-11274083-B2 Substituted thiophenyl uracils, salts thereof and the use thereof as herbicidal agents SYNGENTA CROP PROTECTION AG (CH) 2022-03-15 US claimed
US-6121489-A Selectively N-alkylated peptidomimetic combinatorial libraries and compounds therein TREGA BIOSCIENCES, INC. (US) 2000-09-19 US claimed
EP-1000055-A1 SUBSTITUTED PYRAZOLES AS p38 KINASE INHIBITORS G.D. Searle & Co. (US) 2000-05-17 EP claimed
EP-0890101-A4 SELECTIVELY N-ALKYLATED PEPTIDOMIMETIC COMBINATORIAL LIBRARIES AND COMPOUNDS THEREIN TORREY PINES INST (US) 1999-12-08 EP claimed
WO-1999020617-A1 ANTIINFLAMMATORY THIADIAZOLYL UREAS WHICH ACT AS LFA-1 AND MAC-1 INHIBITORS ACTIVE BIOTECH AB (SE) 1999-04-29 WO claimed
EP-0890101-A1 SELECTIVELY N-ALKYLATED PEPTIDOMIMETIC COMBINATORIAL LIBRARIES AND COMPOUNDS THEREIN TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) 1999-01-13 EP claimed
WO-1998052940-A1 SUBSTITUTED PYRAZOLES AS p38 KINASE INHIBITORS G.D. SEARLE AND CO. (US) 1998-11-26 WO claimed
EP-0766694-B1 PEPTIDE DERIVATIVES WITH METALLOPEPTIDASE INHIBITORY ACTIVITY ZAMBON SPA (IT) 1998-08-05 EP claimed
WO-1997033174-A1 SELECTIVELY N-ALKYLATED PEPTIDOMIMETIC COMBINATORIAL LIBRARIES AND COMPOUNDS THEREIN TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) 1997-09-12 WO claimed
EP-0766694-A1 PEPTIDE DERIVATIVES WITH METALLOPEPTIDASE INHIBITORY ACTIVITY ZAMBON GROUP S.p.A. (IT) 1997-04-09 EP claimed
WO-1995035307-A1 PEPTIDE DERIVATIVES WITH METALLOPEPTIDASE INHIBITORY ACTIVITY ZAMBON GROUP S.P.A. (IT) 1995-12-28 WO claimed