SCHEMBL9832616

SCHEMBL9832616

O=C(Nc1nc(-c2ccco2)cs1)c1nnn[nH]1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.63
KMT2A Q03164 11/20 0.63
ALDH1A1 P00352 10/20 0.63
RAB9A P51151 9/20 0.63
NPC1 O15118 8/20 0.63
MAPT P10636 7/20 0.63
HSD17B10 Q99714 5/20 0.63
TSHR P16473 2/20 0.63
PKM P14618 1/20 0.63
ALOX15 P16050 1/20 0.63
POLB P06746 6/20 0.49
MCL1 Q07820 2/20 0.49
CLK1 P49759 2/20 0.49
SMN1; SMN2 Q16637 6/20 0.48
HTT P42858 3/20 0.47
KDM4E B2RXH2 3/20 0.47
LMNA P02545 2/20 0.47
MAPK1 P28482 3/20 0.47
HPGD P15428 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46

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
SCHEMBL9829808 0.82 RAB9A (0.58) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL9829473 0.81 KDM4E (0.42) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9831525 0.80 NPC1 (0.60) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9832583 0.80 LMNA (0.57) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9831311 0.78 LMNA (0.60) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9829907 0.78 LMNA (0.59) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9831892 0.78 ABL1 (0.60) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9829872 0.77 RAB9A (0.62) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9832536 0.77 LMNA (0.62) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9830542 0.76 ALDH1A1 (0.66) MEN1KMT2AALDH1A1RAB9ANPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0321115-B1 CARBOXAMIDE DERIVATIVES HAVING TETRAZOLE AND THIAZOLE RINGS AND THEIR USE SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-08-14 EP disclosed
US-4946855-A ANTIALLERGIC SAWAI PHARMACEUTICAL CO., LTD. (JP) 1990-08-07 US disclosed
EP-0321115-A1 Carboxamide derivatives having tetrazole and thiazole rings and their use SAWAI PHARMACEUTICAL CO., LTD. (JP) 1989-06-21 EP disclosed