SCHEMBL18493737

SCHEMBL18493737

CCNC(=O)COc1cccc(C(=O)OC)c1C(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.48
▸ ALDH1A1 P00352 5/20 0.47
▸ TSHR P16473 5/20 0.47
▸ RAB9A P51151 3/20 0.46
▸ GAA P10253 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ POLB P06746 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ DDB1 Q16531 1/20 0.43
▸ CRBN Q96SW2 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ MAPK10 P53779 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.42

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
SCHEMBL23868441 0.86 ALDH1A1 (0.49) HSD17B10ALDH1A1TSHRRAB9AGAA
SCHEMBL18475431 0.85 CTSD (0.51) HSD17B10ALDH1A1TSHRPOLBKMT2A
SCHEMBL18475393 0.85 CTSD (0.51) HSD17B10ALDH1A1TSHRPOLBKMT2A
SCHEMBL20919657 0.82 SMN1; SMN2 (0.54) HSD17B10ALDH1A1TSHRSMN1; SMN2POLB
SCHEMBL21543727 0.82 HCRTR1 (0.51) HSD17B10ALDH1A1GAASMN1; SMN2KMT2A
SCHEMBL19068587 0.81 HTT (0.54) HSD17B10ALDH1A1TSHRRAB9ANPC1
SCHEMBL25920599 0.81 TSHR (0.52) HSD17B10ALDH1A1TSHRRAB9ANPC1
SCHEMBL17839975 0.80 HSD17B10 (0.49) HSD17B10ALDH1A1TSHRPOLBKMT2A
SCHEMBL29453458 0.80 HSD17B10 (0.49) HSD17B10ALDH1A1TSHRPOLBKMT2A
SCHEMBL18445963 0.80 CYP1A2 (0.49) HSD17B10ALDH1A1TSHRRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017024317-A2 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-02-09 — — WO disclosed
Send feedback