SCHEMBL15329672

SCHEMBL15329672

O=c1ccccn1Cc1ccc(F)cc1B(O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ KLKB1 P03952 2/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ HTT P42858 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ PSMB1 P20618 1/20 0.36
▸ PSMB5 P28074 1/20 0.36
▸ PREP P48147 1/20 0.36
▸ FAP Q12884 1/20 0.36
▸ PTGER3 P43115 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GAA P10253 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
SCHEMBL15329554 0.82 IDH1 (0.36) ALDH1A1PTGDR2
SCHEMBL15331455 0.82 POLB (0.46) POLBNPSR1ALDH1A1PSMB1PSMB5
SCHEMBL15331970 0.78 POLB (0.43) POLBNPSR1KLKB1ALDH1A1PSMB1
SCHEMBL2555213 0.76 TP53 (0.42) ALDH1A1PTGDR2LMNA
SCHEMBL15331170 0.75 KLKB1 (0.43) POLBNPSR1KLKB1
SCHEMBL30099891 0.72 TNF (0.55) ALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL20547804 0.72 TNF (0.55) ALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL1240350 0.72 MAPT (0.56) POLBNPSR1KLKB1ALDH1A1HTT
SCHEMBL29951642 0.72 KDM4E (0.66) ALDH1A1HTTSMN1; SMN2
SCHEMBL9752644 0.71 POLB (0.58) POLBNPSR1L3MBTL1PSMB1LMNA

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
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