SCHEMBL27897690

SCHEMBL27897690

Clc1cccc(CC2c3ccccc3-c3ccccc32)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 2/20 0.46
C3AR1 Q16581 1/20 0.44
TAAR1 Q96RJ0 2/20 0.43
HTR2A P28223 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
CYP3A4 P08684 2/20 0.42
IDO1 P14902 2/20 0.42
AGXT P21549 2/20 0.42
MEN1 O00255 1/20 0.41
CASP6 P55212 1/20 0.41
KMT2A Q03164 1/20 0.41
GLA P06280 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL27601548 0.90 MEN1 (0.44) PNMTC3AR1IDO1MEN1CASP6
SCHEMBL29007581 0.81 MEN1 (0.47) PNMTC3AR1TAAR1MEN1CASP6
SCHEMBL30396376 0.81 MEN1 (0.47) PNMTC3AR1TAAR1MEN1CASP6
SCHEMBL28801710 0.79 HTR2A (0.47) C3AR1HTR2ASIGMAR1IDO1MEN1
SCHEMBL27915346 0.79 TAAR1 (0.43) TAAR1HTR2AIDO1AGXTSMN1; SMN2
SCHEMBL3918548 0.78 HTR2A (0.54) HTR2AMEN1KMT2AALDH1A1MAPT
SCHEMBL30633024 0.76 CYP11B1 (0.44) CYP3A4MEN1KMT2AGLAKDM4E
SCHEMBL29145549 0.76 CYP11B1 (0.44) CYP3A4MEN1KMT2AGLAKDM4E
SCHEMBL17022656 0.76 HTR2A (0.56) HTR2AKDM4EGAAMAPTL3MBTL1
SCHEMBL6752719 0.75 HTR2A (0.39) HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103204757-B Method for synthesizing single-alkyl fluorene UNIV WENZHOU 2014-11-19 CN disclosed
CN-103012025-A Alkylation method of fluorene UNIV WENZHOU 2013-04-03 CN disclosed