SCHEMBL9722764

SCHEMBL9722764

Nc1nc2ccc(NC=O)cc2s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.55
ALDH1A1 P00352 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
LMNA P02545 3/20 0.52
MAPT P10636 3/20 0.52
HTT P42858 2/20 0.52
HSD17B10 Q99714 2/20 0.52
USP2 O75604 1/20 0.52
RAB9A P51151 6/20 0.51
AXL P30530 1/20 0.51
GFER P55789 1/20 0.51
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KDM4E B2RXH2 1/20 0.51
PKM P14618 1/20 0.51
HPGD P15428 1/20 0.51
KMT2A Q03164 1/20 0.51
NPC1 O15118 5/20 0.50
CYP3A4 P08684 2/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL21709913 0.84 RAB9A (0.51) EPHX2ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL13075992 0.81 LDHA (0.61) ALDH1A1SMN1; SMN2LMNAMAPTHTT
SCHEMBL10477984 0.81 LDHA (0.40) EPHX2ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL12312871 0.79 APP (0.41) EPHX2ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL20247001 0.78 RAB9A (0.61) EPHX2ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL24104135 0.76 EPHX2 (0.68) EPHX2ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL30136375 0.76 EPHX2 (0.68) EPHX2ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL5164106 0.75 RAB9A (0.66) EPHX2ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL6067867 0.75 EPHX2 (0.59) EPHX2ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL21709938 0.75 LMNA (0.67) EPHX2ALDH1A1SMN1; SMN2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024010762-A1 C-MYC MRNA TRANSLATION MODULATORS AND USES THEREOF IN THE TREATMENT OF CANCER ANIMA BIOTECH INC. (US) 2024-01-11 WO disclosed
EP-2429993-B1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INT (DE) 2015-01-21 EP disclosed
US-5120872-A Textile dyeing CIBA-GEIGY CORPORATION (US) 1992-06-09 US disclosed
US-4994563-A Dyeing, printing cellulose, silk, wool, synthetic polyamides; colorfastness CIBA-GEIGY CORPORATION (US) 1991-02-19 US disclosed
EP-0349486-A2 Azo dyes, their preparation and their use CIBA-GEIGY AG (CH) 1990-01-03 EP disclosed
US-4006127-A Cationic diazacyanine dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-02-01 US disclosed