SCHEMBL30881978

SCHEMBL30881978

O=C1CCCc2c1c1ccccc1c1ccccc21

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
MAPT P10636 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
BRD4 O60885 5/20 0.44
PARP1 P09874 1/20 0.43
TP53 P04637 1/20 0.41
CREBBP Q92793 1/20 0.41
CYP2A6 P11509 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
KDM4E B2RXH2 2/20 0.40
DYRK1A Q13627 1/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL8420319 0.87 CHEK1 (0.41) ALDH1A1MAPTNPSR1HSD17B10MEN1
SCHEMBL3898671 0.77 PARP1 (0.45) ALDH1A1HSD17B10MEN1KMT2APARP1
SCHEMBL8662857 0.71 PARP1 (0.50) ALDH1A1HSD17B10PARP1KDM4ELMNA
SCHEMBL23537356 0.69 PARP1 (0.59) ALDH1A1MAPTNPSR1HSD17B10MEN1
SCHEMBL29824193 0.69 PARP1 (0.59) ALDH1A1MAPTNPSR1HSD17B10MEN1
SCHEMBL23537530 0.69 ALDH1A1 (0.47) ALDH1A1MAPTNPSR1HSD17B10MEN1
SCHEMBL14178920 0.68 BCHE (0.39) ALDH1A1HSD17B10MEN1KMT2APARP1
SCHEMBL31180491 0.68 KMT2A (0.46) ALDH1A1MAPTNPSR1HSD17B10MEN1
SCHEMBL10287085 0.68 KMT2A (0.46) ALDH1A1MAPTNPSR1HSD17B10MEN1
SCHEMBL18663354 0.67 CYP1A2 (0.38) ALDH1A1MAPTHSD17B10MEN1KMT2A

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
CN-117736095-A 9, 10-disubstituted phenanthrene compound and synthesis method thereof 河南师范大学 2024-03-22 CN disclosed