SCHEMBL28895776

SCHEMBL28895776

CCC(=O)Oc1c(Cl)ccc(Cl)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.41
KMT2A Q03164 3/20 0.41
HIF1A Q16665 2/20 0.41
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
DPP4 P27487 1/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ELANE P08246 1/20 0.38
ACLY P53396 2/20 0.37
ACHE P22303 3/20 0.36
ALOX15 P16050 1/20 0.36
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
USP2 O75604 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL2898218 0.81 KMT2A (0.48) ESR1KMT2AHIF1ARECQLSMN1; SMN2
SCHEMBL7508588 0.77 SMN1; SMN2 (0.43) KMT2ASMN1; SMN2ALDH1A1KDM4EELANE
SCHEMBL11218291 0.77 KDM4E (0.39) KMT2AHIF1ARECQLSMN1; SMN2ALDH1A1
SCHEMBL5586612 0.76 DPP4 (0.48) ESR1KMT2ADPP4ALDH1A1KDM4E
SCHEMBL28068587 0.75 KMT2A (0.43) ESR1KMT2AHIF1ARECQLSMN1; SMN2
SCHEMBL15547750 0.75 KMT2A (0.43) ESR1KMT2AHIF1ARECQLSMN1; SMN2
SCHEMBL3529575 0.75 SMN1; SMN2 (0.50) ESR1KMT2AHIF1ARECQLSMN1; SMN2
SCHEMBL28163860 0.75 KMT2A (0.40) ESR1KMT2AHIF1ARECQLSMN1; SMN2
SCHEMBL1512534 0.74 ESR1 (0.53) ESR1KMT2AHIF1ARECQLSMN1; SMN2
SCHEMBL7389800 0.74 ACHE (0.43) ESR1KMT2AHIF1ARECQLSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531673-B Herbicidal compounds 先正达参股股份有限公司 2020-12-08 CN disclosed
CN-107580599-B Herbicidal compounds 先正达参股股份有限公司 2020-11-03 CN disclosed
CN-111484509-A Herbicidal compounds 先正达参股股份有限公司 2020-08-04 CN disclosed