SCHEMBL6301620

SCHEMBL6301620

[CH2]C(C)Oc1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 6/20 0.47
SLC6A4 P31645 8/20 0.46
SLC6A2 P23975 5/20 0.46
NR2E1 Q9Y466 5/20 0.46
CYP1A2 P05177 4/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 2/20 0.43
HSD17B10 Q99714 2/20 0.43
PGR P06401 1/20 0.43
GAA P10253 1/20 0.43
PTGS1 P23219 1/20 0.43
HTR1D P28221 1/20 0.43
CYP2D6 P10635 4/20 0.43
ADRB2 P07550 3/20 0.43
ADRB1 P08588 3/20 0.43
HTR2B P41595 3/20 0.43

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
SCHEMBL6831487 0.83 HTR1B (0.50) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL4982131 0.83 CYP1A2 (0.56) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL27613071 0.80 HTR1B (0.47) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL1356983 0.80 HTR1B (0.47) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL27351338 0.80 CYP1A2 (0.54) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL23067897 0.80 HTR1B (0.47) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL8344333 0.80 MCHR1 (0.51) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL1356985 0.80 CYP1A2 (0.54) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL9654112 0.80 HTR1B (0.47) HTR1BSLC6A4SLC6A2NR2E1CYP1A2
SCHEMBL10587442 0.80 HTR1B (0.47) HTR1BSLC6A4SLC6A2NR2E1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3892602-A1 METHOD FOR THE PREPARATION OF DEUTERATED OR TRITIATED COMPOUNDS Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2021-10-13 EP disclosed
US-11078355-B2 (Meth)acrylic copolymer, resin composition, molded body of same, and method for producing molded body MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-08-03 US disclosed
CN-109790366-B (meth) acrylic copolymer, resin composition, molded article thereof, and method for producing molded article 三菱瓦斯化学株式会社 2021-04-27 CN disclosed
EP-3517571-B1 (METH)ACRYLIC COPOLYMER, RESIN COMPOSITION, MOLDED BODY OF SAME, AND METHOD FOR PRODUCING MOLDED BODY MITSUBISHI GAS CHEMICAL CO (JP) 2021-01-06 EP disclosed
CN-104298073-B Colored curable resin composition 东友精细化工有限公司 2019-11-29 CN disclosed
US-20190203031-A1 (METH)ACRYLIC COPOLYMER, RESIN COMPOSITION, MOLDED BODY OF SAME, AND METHOD FOR PRODUCING MOLDED BODY MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-07-04 US disclosed
CN-107001299-A Compound and colored curable resin composition 东友精细化工有限公司 2017-08-01 CN disclosed
EP-2822924-A1 METHOD FOR SYNTHESISING AMINOBIPHENYLS USING ARYL HYDRAZINES BASF SE (DE) 2015-01-14 EP disclosed
CN-104220417-A Method for synthesising aminobiphenyls using aryl hydrazines BASF SE 2014-12-17 CN disclosed
CN-102212168-B Photo-curable resin composition, prism sheet, backlight unit and liquid crystal display device TONGWOO FINE CHEMICALS CO., LTD. (KR) 2014-10-22 CN disclosed
WO-2000023451-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO disclosed
WO-2000023417-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO disclosed
WO-2000023425-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO disclosed
WO-2000023416-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO disclosed
WO-2000023415-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO disclosed
US-5719155-A CARDIOVASCULAR DISORDERS JAPAN TOBACCO INC. (JP) 1998-02-17 US disclosed
EP-0733364-A1 MEDICINAL COMPOSITION FOR CIRCULATORY ORGAN NIPPON SHINYAKU COMPANY, LIMITED (JP) 1996-09-25 EP disclosed
EP-0677519-A1 CHROMAN DERIVATIVE AND MEDICINAL USE THEREOF Japan Tobacco Inc. (JP) 1995-10-18 EP disclosed
EP-0601184-A1 FUSED PYRIDAZINE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-06-15 EP disclosed
CN-1068013-A HERBICIDAL COMPOSITION BAYER AGROCHEM KK (JP) 1993-01-20 CN disclosed