SCHEMBL128347

SCHEMBL128347

CC(C)Oc1cc[c]cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 1/20 0.46
KMT2A Q03164 3/20 0.45
PARP10 Q53GL7 1/20 0.43
POLB P06746 1/20 0.41
GLA P06280 1/20 0.39
ALDH1A1 P00352 4/20 0.38
GAA P10253 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
P2RX3 P56373 1/20 0.35
BRD4 O60885 1/20 0.34
BRPF1 P55201 1/20 0.34
LMNA P02545 3/20 0.34
TP53 P04637 2/20 0.34
MAPK1 P28482 1/20 0.34
PTPN5 P54829 1/20 0.34
MEN1 O00255 1/20 0.34
NOTUM Q6P988 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL27899588 0.97 ALDH1A3 (0.45) ALDH1A3KMT2APARP10POLBGLA
SCHEMBL4735563 0.91 ALDH1A3 (0.45) ALDH1A3KMT2APARP10POLBGLA
SCHEMBL533273 0.86 ALDH1A3 (0.45) ALDH1A3KMT2APARP10POLBGLA
SCHEMBL3931757 0.81 LTA4H (0.44) ALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL9352539 0.80 PARP10 (0.32) ALDH1A3PARP10
SCHEMBL4850886 0.80 PARP10 (0.36) ALDH1A3KMT2APARP10POLBGAA
SCHEMBL5116165 0.80 PARP10 (0.36) ALDH1A3KMT2APARP10POLBGAA
SCHEMBL17134126 0.80 ALDH1A3 (0.30) ALDH1A3
SCHEMBL1607620 0.80 TAS1R3 (0.31) ALDH1A3
SCHEMBL8368010 0.80 ALDH1A3 (0.30) ALDH1A3

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 5025 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114369011-B New green method for preparing 2-diaryl methyl substituted-1-naphthol compound 湖南理工学院 2024-07-09 CN claimed
US-11987588-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of heart failure and disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2024-05-21 US claimed
WO-2024088377-A1 PYRIMIDOPYRROLE ANALOG 香港科技大学 2024-05-02 WO claimed
WO-2024088379-A1 TUMOR TREATMENT OR PREVENTION METHOD 香港科技大学 2024-05-02 WO claimed
US-11958871-B2 Inhibitors of bacterial glutaminyl cyclases for use in the treatment of periodontal and related diseases Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2024-04-16 US claimed
CN-117831652-A Prediction method of olefin hydroformylation positive-to-negative ratio 上海华谊控股集团有限公司 2024-04-05 CN claimed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN claimed
CN-117624092-A Method for preparing N-diaryl methyl substituted-2-amino furan compound 湖南理工学院 2024-03-01 CN claimed
CN-114206886-B Gold (III) compound, method for preparing the same, and organic light emitting device using the same 广东聚华印刷显示技术有限公司 2024-02-27 CN claimed
CN-111757883-B Novel inhibitors of bacterial glutaminyl cyclase for the treatment of periodontal disease and related diseases 弗劳恩霍夫应用研究促进协会 2024-02-13 CN claimed
WO-1995004052-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1995-02-09 WO claimed
WO-1994027972-A1 SUBSTITUTED PYRAZOLINES HAVING INSECTICIDAL AND ACARICIDAL ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 1994-12-08 WO claimed
US-5338742-A Nematicidal use of 4-aralkylpyridines DOWELANCO (US) 1994-08-16 US claimed
WO-1993024474-A1 THIADIAZOLINES AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1993-12-09 WO claimed
EP-0366328-B1 PROCESS FOR PREPARING 4-METHYLPYRAZOLES NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1993-05-19 EP claimed
US-5028705-A Preparation of pyrazolo[5,1-b]quinazolones BASF AKTIENGESELLSCHAFT (DE) 1991-07-02 US claimed
US-4883789-A Substituted phenyltrialkylsilane insecticides FMC CORPORATION (US) 1989-11-28 US claimed
US-4863947-A PESTICIDES, INSECTICIDES ROHM AND HAAS (US) 1989-09-05 US claimed
US-4684664-A BACTERICIDES, FUNGICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-08-04 US claimed
US-4120886-A APHIDICIDES PPG INDUSTRIES, INC. (US) 1978-10-17 US claimed