SCHEMBL15329564

SCHEMBL15329564

Cc1cc(C)n(Cc2ccccc2B(O)O)c(=O)n1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.49
TSHR P16473 2/20 0.48
DCTPP1 Q9H773 1/20 0.47
ALDH1A1 P00352 6/20 0.43
LMNA P02545 4/20 0.43
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 2/20 0.38
LIPG Q9Y5X9 1/20 0.36
POLB P06746 2/20 0.35
KMT2A Q03164 1/20 0.35
CASR P41180 1/20 0.34
HDAC1 Q13547 1/20 0.34
MAPT P10636 1/20 0.33
CMA1 P23946 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL15331061 0.76 DCTPP1 (0.50) HSD17B10TSHRDCTPP1ALDH1A1LMNA
SCHEMBL15332360 0.76 DCTPP1 (0.48) HSD17B10TSHRDCTPP1ALDH1A1LMNA
SCHEMBL15331295 0.74 DCTPP1 (0.40) DCTPP1ALDH1A1LMNANPSR1KDM4E
SCHEMBL15330708 0.69 SMN1; SMN2 (0.40) TSHRDCTPP1ALDH1A1HTTLIPG
SCHEMBL30099872 0.69 GALR3 (0.68) HSD17B10TSHRDCTPP1ALDH1A1LMNA
SCHEMBL22126100 0.69 GALR3 (0.68) HSD17B10TSHRDCTPP1ALDH1A1LMNA
SCHEMBL21352417 0.69 MEN1 (0.42) DCTPP1ALDH1A1LMNAHTTNPSR1
SCHEMBL11829009 0.68 HSD17B10 (0.62) HSD17B10TSHRALDH1A1LMNAHTT
SCHEMBL3114985 0.67 HSD17B10 (0.96) HSD17B10TSHRALDH1A1LMNAHTT
Hydrochloric Acid SCHEMBL6011098 0.66 HSD17B10 (1.00) HSD17B10TSHRALDH1A1LMNAHTT

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