SCHEMBL475603

SCHEMBL475603

CCCCc1ccccc1C

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.58
LIPG Q9Y5X9 1/20 0.48
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CHRM2 P08172 1/20 0.44
KMT2A Q03164 1/20 0.42
TLR8 Q9NR97 1/20 0.42
TSHR P16473 1/20 0.41
ACHE P22303 1/20 0.41
TYR P14679 1/20 0.41
DAO P14920 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CTBP2 P56545 1/20 0.40

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
SCHEMBL29981544 1.00 TAAR1 (0.58) TAAR1LIPGCYP3A4CYP2D6CYP2C9
SCHEMBL5499255 1.00 TAAR1 (0.58) TAAR1LIPGCYP3A4CYP2D6CYP2C9
Butane SCHEMBL28500537 0.98 TAAR1 (0.56) TAAR1LIPGCYP3A4CYP2D6CYP2C9
Bromide SCHEMBL28213899 0.98 TAAR1 (0.56) TAAR1LIPGCYP3A4CYP2D6CYP2C9
SCHEMBL31498542 0.98 TAAR1 (0.56) TAAR1LIPGCYP3A4CYP2D6CYP2C9
Ammonia Solution, Strong SCHEMBL10539792 0.98 TAAR1 (0.56) TAAR1LIPGCYP3A4CYP2D6CYP2C9
Octane SCHEMBL28903149 0.96 LIPG (0.55) TAAR1LIPGCYP3A4CYP2D6CYP2C9
Methoxymethane SCHEMBL22720615 0.96 TAAR1 (0.54) TAAR1LIPGCYP3A4CYP2D6CYP2C9
Hydrogen Peroxide SCHEMBL9770513 0.96 TAAR1 (0.54) TAAR1LIPGCYP3A4CYP2D6CYP2C9
SCHEMBL1087485 0.93 LIPG (0.57) TAAR1LIPGTLR8TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954643-A Method for preparing polyesteramide monomer and method for removing DMAP 连云港邃铸科技有限公司 2025-05-09 CN claimed
CN-119034414-B Separation and recovery method of hydrogen chloride in chlorocyanobenzene production tail gas 江苏维尤纳特精细化工有限公司 2025-04-18 CN claimed
CN-119725415-A Negative electrode material, preparation method thereof and lithium ion battery 贝特瑞新材料集团股份有限公司 2025-03-28 CN claimed
CN-119034414-A Separation and recovery method of hydrogen chloride in chlorocyanobenzene production tail gas 江苏维尤纳特精细化工有限公司 2024-11-29 CN claimed
CN-118994687-A Ultrathin phase-change insulating composite film and preparation method thereof 深圳联腾达科技有限公司 2024-11-22 CN claimed
CN-118271331-A Gelsemin derivatives, synthesis method and application thereof in inhibiting tumor cell proliferation 赣江中药创新中心 2024-07-02 CN claimed
CN-118126615-A Hydrophobic oleophobic coating and preparation method and application thereof 广州大学 2024-06-04 CN claimed
CN-118026836-A Preparation method of 4-tert-butylcyclohexyl acetic acid or ester thereof 中国科学技术大学 2024-05-14 CN claimed
CN-117770366-A Licking brick for solving abnormal behaviors of growing-finishing pigs and preparation method and application thereof 四川德康农牧食品集团股份有限公司 2024-03-29 CN claimed
WO-2024054387-A1 BIS (ARENE) METAL COMPLEXES AND RELATED METHODS ENTEGRIS, INC. (US) 2024-03-14 WO claimed
EP-0070393-B1 PROCESS FOR THE PREPARATION OF AROMATIC MONOCARBOXYLIC ACIDS HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) 1985-05-29 EP claimed
EP-0131001-A1 METHOD FOR PRODUCING AN ALDEHYDE. GIVAUDAN & CIE SA (CH) 1985-01-16 EP claimed
WO-1984002522-A1 METHOD FOR PRODUCING AN ALDEHYDE GIVAUDAN & CIE SA (CH) 1984-07-05 WO claimed
EP-0030588-B1 PROCESS FOR THE PREPARATION OF P-TERT.-BUTYLBENZALDEHYDE F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1984-04-25 EP claimed
EP-0029995-B1 PROCESS FOR THE PREPARATION OF 4-TERT.-BUTYLBENZALDEHYDE BASF Aktiengesellschaft (DE) 1983-05-11 EP claimed
EP-0070393-A1 Process for the preparation of aromatic monocarboxylic acids HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) 1983-01-26 EP claimed
EP-0030588-A1 Process for the preparation of p-tert.-butylbenzaldehyde F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-06-24 EP claimed
EP-0029995-A1 Process for the preparation of 4-tert.-butylbenzaldehyde BASF Aktiengesellschaft (DE) 1981-06-10 EP claimed
US-4249608-A ADDING AS BACTERICIDE BENZENE, TOLUENE, XYLENE OR AN ALKYL-SUBSTITUTED AROMATIC HYDROCARBON; AGING RESISTANCE TEXACO INC. (US) 1981-02-10 US claimed
US-4079175-A CATALYST COMPRISING REFORMED TITANIUM TRICHLORIDE AND ORGANOALUMINUM COMPOUND TOYO STAUFFER CHEMICAL CO., LTD. (JA) 1978-03-14 US claimed