SCHEMBL15628871

SCHEMBL15628871

Fc1cccc(CP(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.46
IDO1 P14902 3/20 0.44
AGXT P21549 2/20 0.44
MIF P14174 1/20 0.41
KDM1A O60341 2/20 0.40
P2RX7 Q99572 2/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.39
SLC6A3 Q01959 1/20 0.39

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
SCHEMBL15516632 0.86 LOXL2 (0.40) TAAR1IDO1MAOAMAOBALDH1A1
SCHEMBL27969132 0.81 TAAR1 (0.52) TAAR1IDO1AGXTSLC6A3
SCHEMBL8860405 0.80 AGXT (0.46) TAAR1AGXTKDM1AMAOA
SCHEMBL230856 0.79 TDP1 (0.43) TAAR1IDO1MAOBALDH1A1SMN1; SMN2
SCHEMBL20015568 0.78 PLA2G1B (0.40) TAAR1IDO1AGXTKDM1AMAOA
SCHEMBL9510728 0.77 TAAR1 (0.54) TAAR1IDO1AGXTMIFMAOB
SCHEMBL19007863 0.77 TP53 (0.48) L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL27810951 0.77 TAAR1 (0.46) TAAR1IDO1MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL11853139 0.77 CYP3A4 (0.41) TAAR1IDO1AGXTMAOAMAOB
Hydrochloric Acid SCHEMBL334217 0.77 CYP3A4 (0.41) TAAR1IDO1AGXTMAOAMAOB

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
EP-2705030-B1 PARTIALLY SATURATED TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC (US) 2016-07-27 EP disclosed
WO-2014071369-A1 TRICYCLIC COMPOUNDS FOR USE IN THE TREATMENT AND/OR CONTROL OF OBESITY ZAFGEN, INC. (US) 2014-05-08 WO disclosed
WO-2014071368-A1 METHODS OF TREATING LIVER DISEASES ZAFGEN, INC. (US) 2014-05-08 WO disclosed
WO-2012154676-A9 PARTIALLY SATURATED TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC. (US) 2014-03-27 WO disclosed