SCHEMBL2556097

SCHEMBL2556097

O=c1cccnn1Cc1ccccc1B(O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ IDO1 P14902 1/20 0.37
▸ DCTPP1 Q9H773 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ GPR35 Q9HC97 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ PKM P14618 1/20 0.33
▸ PKLR P30613 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
SCHEMBL2555213 0.82 TP53 (0.42) IDO1MEN1KMT2AALDH1A1HPGD
SCHEMBL21352417 0.78 MEN1 (0.42) LIPGHDAC1DCTPP1MEN1KMT2A
SCHEMBL28502249 0.76 ALDH1A1 (0.44) IDO1MEN1KMT2AALDH1A1KDM4E
SCHEMBL21352396 0.73 PKM (0.36) HDAC1IDO1MEN1KMT2ASMN1; SMN2
SCHEMBL21352405 0.73 MEN1 (0.39) MEN1KMT2ANPSR1SMN1; SMN2ALDH1A1
SCHEMBL15331455 0.73 POLB (0.46) LIPGNPSR1POLBALDH1A1MAPT
SCHEMBL4489558 0.73 — —
SCHEMBL4182991 0.72 CYP19A1 (0.48) IDO1MEN1KMT2AALDH1A1HPGD
SCHEMBL15331295 0.71 DCTPP1 (0.40) LIPGHDAC1DCTPP1MEN1KMT2A
SCHEMBL21352389 0.71 ENPP2 (0.46) LIPGIDO1DCTPP1MEN1KMT2A

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 7 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
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 — — EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 — — WO disclosed
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