SCHEMBL9713491

SCHEMBL9713491

COc1cc(OC)c(C(=O)Cl)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.58
USP2 O75604 2/20 0.58
MAPK1 P28482 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ABCG2 Q9UNQ0 5/20 0.51
KMT2A Q03164 3/20 0.47
TP53 P04637 2/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C19 P33261 1/20 0.45
ERN1 O75460 1/20 0.44
LMNA P02545 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44

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
SCHEMBL9956291 0.88 CYP3A4 (0.51) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL11540305 0.85 CYP3A4 (0.49) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL11516098 0.83 ACHE (0.48) CYP3A4USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL11855711 0.83 CYP3A4 (0.45) CYP3A4USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL11519119 0.83 ERN1 (0.47) CYP3A4USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL2029772 0.80 CYP3A4 (0.78) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL466144 0.80 CYP3A4 (0.60) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL4907666 0.80 CYP3A4 (0.60) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL939482 0.78 CYP3A4 (0.56) CYP3A4USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL2096044 0.78 CYP3A4 (0.58) CYP3A4USP2MAPK1SMN1; SMN2ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104311874-B Benzophenone derivates and its application in prepared by resistance to irradiation makrolon material 济南大学 2017-12-01 CN disclosed
US-20160003995-A1 OPTICAL FILM, CIRCULARLY POLARIZING PLATE, AND ORGANIC ELECTROLUMINESCENT DISPLAY DEVICE Konica Minolta, Inc. (JP) 2016-01-07 US disclosed
CN-104311874-A Benzophenone derivative and application of benzophenone derivative in preparation of radiation resistant polycarbonate material UNIV JINAN 2015-01-28 CN disclosed
US-5086184-A Herbicides DOWELANCO (US) 1992-02-04 US disclosed
US-4943634-A HERBICIDES ELI LILLY AND COMPANY (US) 1990-07-24 US disclosed
US-4801718-A HERBICIDES ELI LILLY AND COMPANY (US) 1989-01-31 US disclosed
US-4636243-A HERBICIDES ISOXAZOLES ELI LILLY AND COMPANY (US) 1987-01-13 US disclosed
US-4515625-A HERBICIDES ELI LILLY AND COMPANY (US) 1985-05-07 US disclosed
EP-0049071-B1 N-ARYLBENZAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1984-12-19 EP disclosed
US-4416683-A HERBICIDES ELI LILLY AND COMPANY (US) 1983-11-22 US disclosed
EP-0049071-A1 N-arylbenzamide derivatives ELI LILLY AND COMPANY (US) 1982-04-07 EP disclosed
US-4155905-A 6-Substituted penicillanic acid and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1979-05-22 US disclosed
US-4077967-A 6-Substituted penicillanic acid and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1978-03-07 US disclosed
US-4061851-A 7-Amino-7-arylthio cephalosporins E. R. SQUIBB & SONS, INC. (US) 1977-12-06 US disclosed
US-4061629-A 6-Amino-6-arylthio penicillanic acids and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1977-12-06 US disclosed
US-4036877-A Process for the production of aldehydes BUDAPESTI MUSZAKI EGYETEM (HU) 1977-07-19 US disclosed
US-4029669-A 6-Benzalimino-6-arylthio penicillanic acids and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1977-06-14 US disclosed
US-4026886-A 7-Acyl-7-arylthiocephalosporins E. R. SQUIBB & SONS, INC. (US) 1977-05-31 US disclosed
US-3965093-A 6-Arylthio penicillanic acid and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1976-06-22 US disclosed
US-3954744-A ANTIBACTERIAL E. R. SQUIBB & SONS, INC. (US) 1976-05-04 US disclosed