SCHEMBL13765658

SCHEMBL13765658

C1CCC(CP(CC2CCCCC2)CC2CCCCC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.38
CYP1A2 P05177 1/20 0.38
ADRA2C P18825 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
SIGMAR1 Q99720 3/20 0.35
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH4 P08319 1/20 0.35
ADH7 P40394 1/20 0.35
ACHE P22303 1/20 0.32
EPHX1 P07099 3/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
ALOX5 P09917 1/20 0.31

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
SCHEMBL8038613 0.79 CYP1A2 (0.39) CYP1A2
SCHEMBL10356350 0.75 CYP1A2 (0.46) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL9154972 0.75 CHRM5 (0.35) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL9007720 0.73 CHRM5 (0.33) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL8028613 0.71
SCHEMBL3679063 0.69 CYP1A2 (0.41) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL11681143 0.69 CYP1A2 (0.46) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL23070439 0.67 CHRM5 (0.43) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL1524658 0.67 CHRM5 (0.43) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL6532715 0.67 CHRM5 (0.43) CHRM5CYP1A2ADRA2CCHRM2CHRM4

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
US-7557028-B1 For example, making indium phosphide (InP)semiconductors starting from tribenzoyl phosphine and tris-cyclopentadienyl indium; use in photovoltaic devices and light emitting diodes NANOSYS, INC. (US) 2009-07-07 US disclosed