SCHEMBL25818862

SCHEMBL25818862

Cc1cc2nn(C)cc2cc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 4/20 0.46
NSD2 O96028 1/20 0.46
NOTUM Q6P988 2/20 0.36
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
HPGD P15428 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
G6PD P11413 1/20 0.35
CYP2C9 P11712 1/20 0.35
PKM P14618 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
CCR6 P51684 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL24163113 0.92 MAPT (0.46) MAPTKDM4EALDH1A1NSD2NOTUM
SCHEMBL26409412 0.86 MAPT (0.50) MAPTKDM4EALDH1A1NSD2NOTUM
SCHEMBL15730121 0.84 KDM4E (0.52) MAPTKDM4EALDH1A1NSD2NOTUM
SCHEMBL29109563 0.79 KDM4E (0.44) MAPTKDM4EALDH1A1NSD2HPGD
SCHEMBL30665076 0.77 ALDH1A1 (0.55) MAPTKDM4EALDH1A1NSD2NOTUM
SCHEMBL15515928 0.77 MAPT (0.46) MAPTKDM4EALDH1A1NSD2NOTUM
SCHEMBL25104925 0.76 ALDH1A1 (0.53) MAPTKDM4EALDH1A1NSD2NOTUM
SCHEMBL25105491 0.76 MAPT (0.44) MAPTKDM4EALDH1A1NSD2NOTUM
Hydrochloric Acid SCHEMBL31600876 0.76 ALDH1A1 (0.53) MAPTKDM4EALDH1A1NSD2NOTUM
SCHEMBL23643838 0.76 MAPT (0.44) MAPTKDM4EALDH1A1NSD2NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023133217-A1 2-(INDAZOL-5-YL)-6-(PIPERIDIN-4-YL)-1,7-NAPHTHYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS FOR SPLICING NUCLEIC ACIDS AND FOR THE TREATMENT OF PROLIFERATIVE DISEASES REMIX THERAPEUTICS INC. (US) 2023-07-13 WO disclosed