SCHEMBL9723651

SCHEMBL9723651

C=C(C)c1ccccc1CC(C)N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.44
SLC6A2 P23975 3/20 0.44
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 2/20 0.44
MAOA P21397 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
CYP2A6 P11509 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
ADRB1 P08588 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR1E P28566 1/20 0.41
HTR7 P34969 1/20 0.41
HTR2B P41595 1/20 0.41
HTR6 P50406 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
SCHEMBL714466 0.85 GABRA1 (0.50) ADRA2AKMT2A
SCHEMBL10622937 0.83 GABRA1 (0.35) ADRA2A
SCHEMBL8676206 0.81 GABRA1 (0.34) SLC6A2SLC6A4SLC6A3ADRA2A
SCHEMBL1048951 0.81 CYP2D6 (0.46) TAAR1SLC6A2SLC6A4SLC6A3MAOA
SCHEMBL10428570 0.80 IDO1 (0.38) SLC6A2SLC6A4SLC6A3ADRB1HTR1A
SCHEMBL264745 0.78 FOLH1 (0.50) TAAR1SLC6A2SLC6A4SLC6A3MAOA
SCHEMBL17374631 0.78 IRAK4 (0.47) TAAR1SLC6A2SLC6A4SLC6A3MAOA
SCHEMBL6839201 0.78 FOLH1 (0.50) TAAR1SLC6A2SLC6A4SLC6A3MAOA
SCHEMBL11141533 0.78 FOLH1 (0.50) TAAR1SLC6A2SLC6A4SLC6A3MAOA
SCHEMBL7526048 0.77 ELANE (0.37) TAAR1ADRA2AKMT2A

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
US-5112924-A Multilayer fabric, fiber or particle composite of improved heat resistance and high strength HERCULES INCORPORATED (US) 1992-05-12 US disclosed
US-5096766-A Prepregs HERCULES INCORPORATED (US) 1992-03-17 US disclosed