SCHEMBL15330792

SCHEMBL15330792

O=Cc1ncn2c1CNc1c(F)cccc1-2

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 5/20 0.35
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
SCN9A Q15858 1/20 0.30

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
SCHEMBL21352415 0.82 GABRP (0.32) GABRG2GABRB3GABRA5
SCHEMBL2232968 0.67 KDM4E (0.31) KDM4E
SCHEMBL2236516 0.66 SRD5A1 (0.43) HCAR1GABRG2GABRB3GABRA5MEN1
SCHEMBL2235135 0.66 NOTUM (0.39) HCAR1GABRG2GABRB3GABRA5
SCHEMBL2237635 0.66 NOTUM (0.38) HCAR1GABRG2GABRB3GABRA5MEN1
SCHEMBL2237477 0.64 HCAR1 (0.33) HCAR1
SCHEMBL2234607 0.64 HCAR1 (0.40) HCAR1KDM4EMEN1KMT2A
SCHEMBL1346416 0.62 BRPF1 (0.56) MEN1KMT2ASCN9A
SCHEMBL23050238 0.62 IDH1 (0.41) HCAR1GABRG2GABRB3GABRA5KDM4E
SCHEMBL7271413 0.60 GABRG2 (0.57) GABRG2GABRB3GABRA5

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 4 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-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