SCHEMBL2561428

SCHEMBL2561428

O=CCC(=O)c1ccc2ccccc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.65
SMN1; SMN2 Q16637 6/20 0.59
ALDH1A1 P00352 6/20 0.59
HPGD P15428 3/20 0.59
KDM4E B2RXH2 3/20 0.59
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
MAPT P10636 2/20 0.59
EGFR P00533 1/20 0.59
TP53 P04637 1/20 0.59
CYP3A4 P08684 1/20 0.59
PKM P14618 1/20 0.59
ALOX15 P16050 1/20 0.59
ALOX12 P18054 1/20 0.59
JAK1 P23458 1/20 0.59
MAPK1 P28482 1/20 0.59
HSD17B10 Q99714 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
CES2 O00748 1/20 0.59
CES1 P23141 1/20 0.59

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
SCHEMBL31379003 1.00 PTPN1 (0.65) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL12050097 0.84 SMN1; SMN2 (0.63) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL9575208 0.83 KDM4E (0.68) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL1974978 0.82 PTPN1 (0.71) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL29489791 0.82 PTPN1 (0.71) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL2562468 0.81 CYP1A2 (0.68) SMN1; SMN2ALDH1A1HPGDKDM4EKMT2A
SCHEMBL19287159 0.81 HDAC1 (0.60) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL1448153 0.80 PTPN1 (0.69) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL28345275 0.80 PTPN1 (0.69) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL30375368 0.80 PTPN1 (0.69) PTPN1SMN1; SMN2ALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-115093323-A Beta-functionalized chiral homoallyl alcohol derivative and preparation method and application thereof 武汉大学 2022-09-23 CN disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-9074109-B2 Fluorine-containing polymer, the preparation process and use thereof, pigment dispersion and the preparation process BOE TECHNOLOGY GROUP CO., LTD. (CN) 2015-07-07 US disclosed
US-20140142220-A1 FLUORINE-CONTAINING POLYMER, THE PREPARATION PROCESS AND USE THEREOF, PIGMENT DISPERSION AND THE PREPARATION PROCESS BOE TECHNOLOGY GROUP CO., LTD. (CN) 2014-05-22 US disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
CN-102656256-A Lubricating oil composition containing titanium complex CHEVRON ORONITE CO 2012-09-05 CN disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed