SCHEMBL15330749

SCHEMBL15330749

Cc1cccc(-c2nnc(C=O)[nH]2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PBRM1 Q86U86 1/20 0.42
NR1I3 Q14994 1/20 0.41
NPBWR1 P48145 1/20 0.40
XDH P47989 1/20 0.40
TYMP P19971 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NOTUM Q6P988 1/20 0.39
NPY5R Q15761 1/20 0.38
IDO1 P14902 1/20 0.38
METAP2 P50579 1/20 0.38

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
SCHEMBL15330500 0.81 HRH1 (0.47) PIN1NPC1RAB9ANPBWR1TYMP
SCHEMBL15330804 0.81 PIN1 (0.44) PIN1TYMPALDH1A1NOTUMIDO1
SCHEMBL15331667 0.81 HRH1 (0.47) NPC1RAB9ATYMPALDH1A1HPGD
SCHEMBL15332153 0.80 PIN1 (0.48) PIN1NR1I3TYMPALDH1A1
SCHEMBL15332178 0.80 TNKS (0.40) NPC1RAB9ANPBWR1TYMPL3MBTL1
SCHEMBL2558505 0.79 NPC1 (0.52) PIN1NPC1RAB9AL3MBTL1ALDH1A1
SCHEMBL416478 0.78 NR1I3 (0.50) PIN1NPC1RAB9APBRM1NR1I3
SCHEMBL15331688 0.77 PIN1 (0.47) PIN1XDHTYMPNOTUMIDO1
SCHEMBL15329978 0.77 SCN2A (0.51) PIN1NPC1RAB9AXDHTYMP
SCHEMBL22307332 0.75 PIN1 (0.43) PIN1NPC1RAB9APBRM1NR1I3

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