SCHEMBL27654170

SCHEMBL27654170

CCC1CCc2cc(C(F)(F)F)ccc2N1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 5/20 0.52
▸ SRD5A1 P18405 1/20 0.38
▸ PNMT P11086 4/20 0.38
▸ HTR2A P28223 3/20 0.38
▸ HTR2C P28335 3/20 0.38
▸ HTR2B P41595 3/20 0.38
▸ KIF11 P52732 3/20 0.38
▸ MTNR1A P48039 2/20 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
SCHEMBL30738393 1.00 AR (0.52) ARSRD5A1PNMTHTR2AHTR2C
SCHEMBL9064740 0.90 AR (0.50) ARPNMTHTR2AHTR2CHTR2B
SCHEMBL6754129 0.90 AR (0.46) ARSRD5A1HTR2AHTR2CHTR2B
SCHEMBL6754125 0.90 AR (0.46) ARSRD5A1HTR2AHTR2CHTR2B
SCHEMBL6754126 0.90 AR (0.46) ARSRD5A1HTR2AHTR2CHTR2B
Ethoxycarbonyl Group SCHEMBL29291835 0.88 AR (0.46) ARSRD5A1KIF11MTNR1A
SCHEMBL22297852 0.87 AR (0.44) ARPNMTKIF11MTNR1A
SCHEMBL6754201 0.85 AR (0.38) ARSRD5A1PNMTKIF11
SCHEMBL6754202 0.85 AR (0.38) ARSRD5A1PNMTKIF11
SCHEMBL6752929 0.85 AR (0.40) ARSRD5A1PNMTHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108558-B The method that preparation is used to prepare the synthetic intermediate of tetrahydroquinoline derivative 狄智玛制药私人有限公司 2019-11-19 — — CN disclosed
CN-100528878-C Tetrahydroquinoline derivatives and process for producing the same TANABE SEIYAKU CO (JP) 2009-08-19 — — CN disclosed
CN-101381345-A Tetrahydroquinoline derivatives and a process for preparing the same TANABE SEIYAKU CO (JP) 2009-03-11 — — CN disclosed
CN-1938314-A Tetrahydroquinoline derivatives and process for producing the same TANABE SEIYAKU CO (JP) 2007-03-28 — — CN disclosed
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