SCHEMBL30050788

SCHEMBL30050788

O=c1oc2ccccc2c(Br)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.58
NQO1 P15559 7/20 0.56
ALDH1A1 P00352 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ABCB11 O95342 1/20 0.56
LMNA P02545 1/20 0.56
TP53 P04637 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
CYP2C19 P33261 1/20 0.56
PDE4D Q08499 1/20 0.56
PCSK7 Q16549 1/20 0.56
GPR35 Q9HC97 1/20 0.56
CA12 O43570 2/20 0.53
CA9 Q16790 2/20 0.53
VKORC1 Q9BQB6 3/20 0.53

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
SCHEMBL669541 1.00 KDM4E (0.58) KDM4ENQO1ALDH1A1MEN1KMT2A
SCHEMBL669540 0.85 KDM4E (0.62) KDM4ENQO1ALDH1A1MEN1KMT2A
SCHEMBL29379994 0.82 KDM4E (0.69) KDM4ENQO1ALDH1A1MEN1KMT2A
SCHEMBL5472418 0.82 HSD17B10 (0.54) KDM4ENQO1ALDH1A1MEN1KMT2A
SCHEMBL29872 0.82 KDM4E (0.69) KDM4ENQO1ALDH1A1MEN1KMT2A
SCHEMBL7737431 0.82 KDM4E (0.69) KDM4ENQO1ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL8701572 0.80 KDM4E (0.67) KDM4ENQO1ALDH1A1MEN1KMT2A
SCHEMBL30153359 0.77 KDM4E (0.73) KDM4ENQO1ALDH1A1MEN1KMT2A
SCHEMBL5532851 0.77 KDM4E (0.73) KDM4ENQO1ALDH1A1MEN1KMT2A
SCHEMBL31178946 0.77 GAA (0.69) KDM4ENQO1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250189425-A1 NANOSENSORS AND USE THEREOF NANOMOSAIC INC (US) 2025-06-12 US disclosed
WO-2022220019-A1 LONG-CHAIN DNA SYNTHESIS USING NON-NATURAL BASE 国立大学法人東京工業大学 2022-10-20 WO disclosed