SCHEMBL7649355

SCHEMBL7649355

[CH2]CCCCCc1cc(-c2ccccc2)cc2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 4/20 0.37
CHRNA10 Q9GZZ6 4/20 0.37
CHRNA9 Q9UGM1 4/20 0.37
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
HTR6 P50406 2/20 0.36
MAPT P10636 2/20 0.33
TACR3 P29371 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
MPI P34949 1/20 0.33
KMT2A Q03164 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MC4R P32245 1/20 0.32
PTGES O14684 1/20 0.32

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
SCHEMBL7655581 0.98 HTR6 (0.37) CHRNA7CHRNA10CHRNA9MTNR1AMTNR1B
SCHEMBL7647401 0.94 HTR6 (0.38) CHRNA7CHRNA10CHRNA9MTNR1AMTNR1B
SCHEMBL7649102 0.87 HTR6 (0.40) MTNR1AMTNR1BHTR6MAPTTACR3
SCHEMBL27550729 0.83 MAPT (0.46) MTNR1AMTNR1BMAPTTACR3KDM4E
SCHEMBL7650707 0.80 HTR6 (0.41) MTNR1AMTNR1BHTR6MAPTTACR3
SCHEMBL7652962 0.79 CYP1A2 (0.46) MAPTTDP1
SCHEMBL7654083 0.79 MAPT (0.40) MTNR1AMAPTKDM4EMEN1ALDH1A1
SCHEMBL7652971 0.78 ESR1 (0.34) MAPTKDM4EKMT2A
SCHEMBL7763131 0.78 NQO2 (0.47) MAPTKDM4EMEN1ALDH1A1HPGD
SCHEMBL7655964 0.78 CYP1A2 (0.47) MAPTMEN1KMT2ASIGMAR1TDP1

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
US-6492364-B1 Triazolo and derivatives as chemokine inhibitors TORAY INDUSTRIES, INC. (JP) 2002-12-10 US disclosed
CN-1293674-A Triazolo gerivatives and chemokine inhibitors containing the same as the active ingredient TORAY INDUSTRIES (JP) 2001-05-02 CN disclosed
EP-1067130-A1 TRIAZOLO DERIVATIVES AND CHEMOKINE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT TORAY INDUSTRIES, INC. (JP) 2001-01-10 EP disclosed