SCHEMBL29012500

SCHEMBL29012500

OC(c1c[nH]c2ccccc12)C(F)(F)C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.49
FFAR1 O14842 2/20 0.49
MAPT P10636 5/20 0.48
MAPK1 P28482 2/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 2/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
CYP2C19 P33261 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GAA P10253 2/20 0.42

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
SCHEMBL29012496 0.90 GPR84 (0.46) GPR84FFAR1MAPTMAPK1HTR2A
SCHEMBL29012494 0.89 GPR84 (0.45) GPR84FFAR1MAPTMAPK1HTR2A
SCHEMBL8388628 0.86 GPR84 (0.51) GPR84FFAR1MAPTMAPK1HTR2A
SCHEMBL29543152 0.79 GPR84 (0.61) GPR84FFAR1MAPTMAPK1HTR2A
SCHEMBL5641261 0.76 GPR84 (0.60) GPR84FFAR1MAPTHTR2AHTR2C
SCHEMBL8213938 0.76 MAPT (0.67) GPR84FFAR1MAPTHTR2AHTR2C
SCHEMBL27581588 0.75 GPR84 (0.47) GPR84FFAR1MAPTMAPK1HTR2A
SCHEMBL28555239 0.74 GPR84 (0.53) GPR84FFAR1MAPTHTR2AHTR2C
SCHEMBL5642067 0.73 GPR84 (0.56) GPR84FFAR1MAPTHTR2AHTR2C
SCHEMBL30579357 0.73 GPR84 (0.67) GPR84FFAR1MAPTMAPK1HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117843550-B 10-Perfluoroalkyl-5, 10-indano [1,2-b ] indole compound and synthesis method thereof 南京林业大学 2025-02-25 CN disclosed
CN-117843550-A 10-perfluoroalkyl-5, 10-indano [1,2-b ] indole compound and synthesis method thereof 南京林业大学 2024-04-09 CN disclosed
CN-116063223-A 10-perfluoroalkyl-5, 10-indano [1,2-b ] indole compound and synthesis method thereof 南京林业大学 2023-05-05 CN disclosed