SCHEMBL312843

SCHEMBL312843

[CH2]c1ccc(O)c(C(C)(C)C)c1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
ALOX15 P16050 3/20 0.38
HSD17B10 Q99714 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 2/20 0.37
TYR P14679 2/20 0.37
NR1I2 O75469 1/20 0.37
CYP2C9 P11712 1/20 0.37
MIF P14174 1/20 0.37
HTT P42858 1/20 0.37
NFE2L2 Q16236 1/20 0.37
TSHR P16473 1/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 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
SCHEMBL30027143 0.84 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL70068 0.84 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL10434614 0.79 ALDH1A1 (0.43) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL5694506 0.77 ALDH1A1 (0.42) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL29359879 0.73 ESR1 (0.43) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL30048420 0.73 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL142313 0.73 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL36472 0.73 ESR1 (0.43) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL11480086 0.73 ALDH1A1 (0.43) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL8819969 0.72 ALDH1A1 (0.42) ALDH1A1ALOX15HSD17B10TDP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110272386-B Preparation method of nodispat 上海医药集团青岛国风药业股份有限公司 2022-09-09 CN claimed
WO-2019174631-A1 METHOD FOR PREPARING NORSTAT 上海医药集团股份有限公司 2019-09-19 WO claimed
US-5597943-A Phospholipase A2 inhibitor SHIONOGI & CO., LTD. (JP) 1997-01-28 US claimed
CN-115246789-B Preparation method of nodestrat 上海医药集团青岛国风药业股份有限公司 2023-10-17 CN disclosed
CN-115246789-A Preparation method of nodispat 上海医药集团青岛国风药业股份有限公司 2022-10-28 CN disclosed
CN-110272386-B Preparation method of nodispat 上海医药集团青岛国风药业股份有限公司 2022-09-09 CN disclosed
CN-107954931-B Preparation method of nodispat 上海医药集团青岛国风药业股份有限公司 2021-06-22 CN disclosed
CN-110709254-A Printed matter and method for producing printed matter 世联株式会社 2020-01-17 CN disclosed
WO-2019174631-A1 METHOD FOR PREPARING NORSTAT 上海医药集团股份有限公司 2019-09-19 WO disclosed
US-8586762-B2 Process for producing fused imidazole compound, reformatsky reagent in stable form, and process for producing the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-11-19 US disclosed
EP-1471056-B1 PROCESS FOR PRODUCING FUSED IMIDAZOLE COMPOUND, REFORMATSKY REAGENT IN STABLE FORM, AND PROCESS FOR PRODUCING THE SAME TAKEDA PHARMACEUTICAL (JP) 2012-07-11 EP disclosed
EP-0238164-A1 Liquid crystal panel RAYCHEM CORPORATION (US) 1987-09-23 EP disclosed
US-4514333-A BACTERICIDES QUEEN'S UNIVERSITY AT KINGSTON (CA) 1985-04-30 US disclosed
US-4391975-A TREATING AN AZETIDINE DERIVATIVE WITH A FLUORINE COMPOUND TO EFFECT CYCLIZATION QUEEN'S UNIVERSITY AT KINGSTON (CA) 1983-07-05 US disclosed
US-4323567-A BACTERICIDES NARISADA MASAYUKI 1982-04-06 US disclosed
US-4203982-A Arylmalonamidomethoxycephalosporins SHIONOGI & CO., LTD. (JP) 1980-05-20 US disclosed
US-4201782-A BACTERICIDES SHIONOGI & CO., LTD. (JP) 1980-05-06 US disclosed
US-4183928-A Haloarylmalonamidooxacephalosporins SHIONOGI AND CO., LTD. (JP) 1980-01-15 US disclosed
US-4180571-A Arylmalonamido-1-oxadethiacephalosporins SHIONOGI & CO., LTD. (JP) 1979-12-25 US disclosed
US-4138486-A BACTERICIDES SHIONOGI & CO., LTD. (JP) 1979-02-06 US disclosed