SCHEMBL7672914

SCHEMBL7672914

CCC1C(=O)CC(C)(C)CC1=S

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.57
ALDH1A1 P00352 11/20 0.43
POLB P06746 3/20 0.43
TSHR P16473 2/20 0.43
KDM4E B2RXH2 2/20 0.43
KMT2A Q03164 6/20 0.39
HTT P42858 2/20 0.39
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP1A2 P05177 1/20 0.37
LMNA P02545 2/20 0.34
HPGD P15428 2/20 0.34
HIF1A Q16665 1/20 0.33
TP53 P04637 1/20 0.33
HSD17B10 Q99714 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PKM P14618 1/20 0.33
RECQL P46063 1/20 0.33
MCL1 Q07820 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL5612700 0.85 MAPT (0.70) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL8154627 0.73 MAPT (1.00) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL10794719 0.69 MAPT (0.59) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL3666632 0.68 MAPT (0.57) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL11108623 0.66 MAPT (0.38) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL1219343 0.65 MAPT (0.59) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL10932176 0.63 MAPT (0.50) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL368265 0.63 MAPT (0.56) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL9396153 0.63 ALDH1A1 (0.76) MAPTALDH1A1POLBTSHRKDM4E
SCHEMBL11113058 0.63 MAPT (0.56) MAPTALDH1A1POLBTSHRKDM4E

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56061305-A None JP disclosed
WO-2023033180-A1 R-ENANTIOMER OF AZOLE DERIVATIVE, AGRICULTURAL OR HORTICULTURAL CHEMICAL AGENT, AND INDUSTRIAL MATERIAL PROTECTIVE AGENT 株式会社クレハ 2023-03-09 WO disclosed
EP-3704940-A1 AGROCHEMICAL EMULSIFIABLE CONCENTRATE COMPOSITION Nippon Soda Co., Ltd. (JP) 2020-09-09 EP disclosed
US-20200245614-A1 AGROCHEMICAL EMULSIFIABLE CONCENTRATE COMPOSITION NIPPON SODA CO., LTD. (JP) 2020-08-06 US disclosed
WO-2020032224-A1 COATED BIOLOGICALLY ACTIVE SUBSTANCE 三洋化成工業株式会社 2020-02-13 WO disclosed
WO-2019172381-A1 SPREADING AGENT FOR AGROCHEMICALS, AND AGROCHEMICAL SPRAY LIQUID 株式会社クラレ 2019-09-12 WO disclosed
WO-2019156246-A1 COMPOSITION FOR PEST CONTROL 全国農業協同組合連合会 2019-08-15 WO disclosed
US-6492404-B1 EFFICACIOUS, SAFE NIPPON SODA CO., LTD. (JP) 2002-12-10 US disclosed
CN-1332767-A Particle containing crosslinked polyamino acid MITSUI CHEMICALS INC (JP) 2002-01-23 CN disclosed
EP-1152024-A1 PARTICLE CONTAINING CROSSLINKED POLYAMINO ACID Mitsui Chemicals, Inc. (JP) 2001-11-07 EP disclosed
EP-1114820-A1 THIAZOLYLCINNAMONITRILES AND PEST CONTROLLING AGENTS NIPPON SODA CO., LTD. (JP) 2001-07-11 EP disclosed
EP-0712847-A1 IMIDAZOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PEST CONTROL DRUG NIPPON SODA CO., LTD. (JP) 1996-05-22 EP disclosed
EP-0547557-B1 N-vinylimidazolidine derivatives, preparation thereof, insecticides containing same as an effective ingredient and intermediates thereof MITSUI TOATSU CHEMICALS (JP) 1994-07-27 EP disclosed
US-5310920-A N-vinylimidazolidine derivatives insecticides containing same as an effective ingredient MITSUI TOATSU CHEMICALS, INC. (JP) 1994-05-10 US disclosed
US-5290752-A Method for preparation of a shaped chitin body containing a physiologically active substance UNITIKA LTD. (JP) 1994-03-01 US disclosed
EP-0547557-A1 N-vinylimidazolidine derivatives, preparation thereof, insecticides containing same as an effective ingredient and intermediates thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-06-23 EP disclosed
EP-0159139-B1 METHOD FOR PREPARATION OF A SHAPED CHITIN BODY CONTAINING A PHYSIOLOGICALLY ACTIVE SUBSTANCE UNITIKA LTD. (JP) 1990-02-28 EP disclosed
EP-0159139-A2 Method for preparation of a shaped chitin body containing a physiologically active substance UNITIKA LTD. (JP) 1985-10-23 EP disclosed
JP-S5661305-A EXTERMINATION OF BURSAPHELENCHUS LIGNICOLUS KYOWA SANGYO KK 1981-05-26 JP disclosed