SCHEMBL25637787

SCHEMBL25637787

C=C(C)c1nc(C)c(C)c(C)c1C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL18053236 0.80 SMN1; SMN2 (0.39) CYP1A2SMN1; SMN2
SCHEMBL15959636 0.75
SCHEMBL12758040 0.75 PDE10A (0.38) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL11940152 0.73 KDM4E (0.39) KDM4EALDH1A1LMNA
Methacrylic Acid SCHEMBL28784938 0.73 SMN1; SMN2 (0.38) KDM4EALDH1A1CYP1A2HPGDSMN1; SMN2
SCHEMBL77010 0.67 IDO1 (0.35) LMNASMN1; SMN2
SCHEMBL14310461 0.65 LMNA (0.46) KDM4EALDH1A1CYP1A2HPGDLMNA
SCHEMBL26735287 0.63 CASP3 (0.37) ALDH1A1SMN1; SMN2
SCHEMBL13788780 0.62 PDE10A (0.36) ALDH1A1HPGDSMN1; SMN2
SCHEMBL9327401 0.62 PDE10A (0.44) KDM4EALDH1A1CYP1A2HPGDSMN1; SMN2

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
US-20230200099-A1 ORGANIC LIGHT-EMITTING DIODE WITH HIGH EFFICIENCY AND LONG LIFESPAN SFC CO., LTD. (KR) 2023-06-22 US disclosed