SCHEMBL827345

SCHEMBL827345

CCC(CC)(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.56
ESR2 Q92731 5/20 0.56
KCNN4 O15554 4/20 0.48
AR P10275 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
MAPK1 P28482 1/20 0.42
TSHR P16473 2/20 0.41
TP53 P04637 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL17931717 0.86 ESR1 (0.50) ESR1ESR2KCNN4ARALDH1A1
SCHEMBL28613436 0.86 ESR1 (0.83) ESR1ESR2ARTSHRALDH1A1
SCHEMBL27949011 0.86 ESR1 (0.45) ESR1ESR2KCNN4ARTAAR1
SCHEMBL31402690 0.86 ESR1 (0.45) ESR1ESR2KCNN4ARTAAR1
SCHEMBL17935605 0.86 ALDH1A1 (0.61) ESR1ESR2KCNN4ARTSHR
SCHEMBL1244899 0.85 ESR1 (0.43) ESR1ESR2KCNN4ARTAAR1
SCHEMBL11297940 0.85 ESR1 (0.48) ESR1ESR2KCNN4ARTAAR1
SCHEMBL285366 0.85 ESR1 (0.50) ESR1ESR2KCNN4ARTAAR1
SCHEMBL2086206 0.85 TAAR1 (0.54) ESR1ESR2KCNN4TAAR1
SCHEMBL9330404 0.84 ESR1 (0.48) ESR1ESR2KCNN4ARMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105949925-B A kind of business warm ventilation pipe top layer antirust agent and its preparation method and application 江苏建筑职业技术学院 2017-12-26 CN claimed
CN-103797083-A Flexible bismaleimide, benzoxazine, epoxy-anhydride adduct hybrid adhesive PROTAVIC KOREA CO LTD 2014-05-14 CN claimed
EP-1141222-A1 MULTI-PHASE CLEANING AGENT WITH AN ALKOXYLATED DIHYDROXY AROMATIC COMPOUND Henkel Kommanditgesellschaft auf Aktien (DE) 2001-10-10 EP claimed
WO-2000039271-A1 MULTI-PHASE CLEANING AGENT WITH AN ALKOXYLATED DIHYDROXY AROMATIC COMPOUND HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-07-06 WO claimed
US-12159967-B2 Nonaqueous electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-12-03 US disclosed
EP-4318719-A2 NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2024-02-07 EP disclosed
EP-4030524-B1 NONAQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEM CORP (JP) 2024-02-07 EP disclosed
US-20230343990-A1 NONAQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2023-10-26 US disclosed
US-11784342-B2 Nonaqueous electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2023-10-10 US disclosed
CN-116239974-A Film material and conductive adhesive film using the same 南通德聚半导体材料有限公司 2023-06-09 CN disclosed
US-11623813-B2 Resin composition-filled syringe, and production method and preservation method for same NAMICS CORPORATION (JP) 2023-04-11 US disclosed
US-20220384840-A1 NONAQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2022-12-01 US disclosed
EP-0262456-A2 New electrical insulating oil composition NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-04-06 EP disclosed
EP-0110732-B1 PROCESS FOR PRODUCING DIPHENYLMETHANE DICARBAMATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1987-03-11 EP disclosed
EP-0123412-B1 METHOD FOR MANUFACTURE OF DIPHENYLMETHANE DIISOCYANATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-07-09 EP disclosed
US-4552974-A Process for producing diphenylmethane dicarbamates ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-11-12 US disclosed
US-4547322-A Method for manufacture of diphenylmethane diisocyanates ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-10-15 US disclosed
EP-0123412-A1 Method for manufacture of diphenylmethane diisocyanates Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-10-31 EP disclosed
EP-0110732-A2 Process for producing diphenylmethane dicarbamates Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-06-13 EP disclosed
EP-0050780-A1 Isocyanato-oxazolinones, method for the preparation of oxazolidin-2-one rings containing plastics precursors, and their use in the preparation of high-molecular plastics BAYER AG (DE) 1982-05-05 EP disclosed