SCHEMBL29127675

SCHEMBL29127675

O=CC1c2ccccc2CC1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.41
HTR2A P28223 2/20 0.38
HTR2C P28335 2/20 0.38
HTR2B P41595 2/20 0.38
HRH3 Q9Y5N1 2/20 0.38
SOAT1 P35610 1/20 0.38
F2R P25116 1/20 0.36
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
PRCP P42785 1/20 0.36

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
SCHEMBL29646020 0.74 KDM1A (0.43) SIGMAR1HTR2AKDM1A
SCHEMBL6023657 0.74 ANPEP (0.37) KDM1A
SCHEMBL2822825 0.72 PARP3 (0.46) SIGMAR1HTR2AHTR2CHTR2BHRH3
SCHEMBL11765843 0.72 SIGMAR1 (0.45) SIGMAR1HTR2AHTR2CHTR2BHRH3
SCHEMBL28969529 0.71 SIGMAR1 (0.41) SIGMAR1HTR2AHTR2CHTR2BHRH3
SCHEMBL8364875 0.70 PRCP (0.33) SIGMAR1KDM1APRCP
SCHEMBL14555195 0.69 SIGMAR1 (0.42) SIGMAR1HTR2AHTR2CHTR2BHRH3
SCHEMBL12719040 0.69 KDM1A (0.44) SIGMAR1HTR2AKDM1APRCP
SCHEMBL30799362 0.68 SOAT1 (0.41) SIGMAR1SOAT1
SCHEMBL11881965 0.66 SIGMAR1 (0.66) SIGMAR1HTR2AHTR2CHTR2BHRH3

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-115894141-B Method for synthesizing acyl indene alkane derivative 贺州学院 2023-12-22 CN disclosed