SCHEMBL15330274

SCHEMBL15330274

CCc1ccc(CCC=O)s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.36
MAPK1 P28482 2/20 0.36
HPGD P15428 4/20 0.35
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KMT2A Q03164 3/20 0.33
MAPT P10636 3/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
GAA P10253 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
EGFR P00533 1/20 0.33
ATM Q13315 1/20 0.33
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL4148228 0.79 PRMT6 (0.45) ALDH1A1HPGDRAB9ASMN1; SMN2KMT2A
SCHEMBL18067901 0.79 TSHR (0.33) ALDH1A1MAPK1HPGDKMT2AMAPT
SCHEMBL18725105 0.78 ALDH1A1 (0.41) ALDH1A1MAPK1HPGDRAB9ASMN1; SMN2
SCHEMBL45854 0.76
SCHEMBL2557730 0.75 MMP8 (0.45) ALDH1A1HPGDRAB9ASMN1; SMN2KMT2A
SCHEMBL8645292 0.75 KDM4E (0.37) ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL10175255 0.75 ALDH1A1 (0.36) ALDH1A1MAPK1HPGDRAB9ASMN1; SMN2
SCHEMBL8651651 0.75 DAO (0.39) ALDH1A1
SCHEMBL4096471 0.73 ADH1B (0.41) ALDH1A1HPGDRAB9ASMN1; SMN2NPC1
SCHEMBL3503770 0.71 MAPT (0.42) ALDH1A1HPGDKMT2AMAPTUSP2

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 5 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
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-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed