SCHEMBL17414710

SCHEMBL17414710

OCc1cccc(F)c1C(Cl)(Cl)Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.37
GAA P10253 1/20 0.35
HTT P42858 1/20 0.34
APOBEC3G Q9HC16 1/20 0.33
PDK2 Q15119 1/20 0.33
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
KCNN4 O15554 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP1A2 P05177 1/20 0.32
GLA P06280 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
IDO1 P14902 2/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 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
SCHEMBL488739 0.82 PDK2 (0.41) TAAR1HTTAPOBEC3GPDK2PDCD1
SCHEMBL25535141 0.80 RIPK1 (0.36) TAAR1APOBEC3GPDK2PDCD1CD274
SCHEMBL26416301 0.78 TAAR1 (0.38) TAAR1GAAHTTCYP1A2CYP3A4
SCHEMBL17696930 0.72 TSHR (0.39) TAAR1GAAHTTMEN1KMT2A
SCHEMBL6724455 0.72 TAAR1 (0.41) TAAR1GAAHTTAPOBEC3GPDK2
SCHEMBL31145066 0.72 GPR84 (0.42) TAAR1APOBEC3GPDCD1CD274KCNN4
SCHEMBL595715 0.72 GPR84 (0.42) TAAR1APOBEC3GPDCD1CD274KCNN4
SCHEMBL16822092 0.72 P2RX7 (0.40) TAAR1PDK2CYP1A2IDO1
SCHEMBL17414713 0.72 NR4A2 (0.33) APOBEC3GPDK2PDCD1CD274GABRA1
SCHEMBL27879107 0.72 TAAR1 (0.43) TAAR1GAAHTTMEN1KMT2A

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
EP-2935508-B1 TRACERS RESTRACK AS (NO) 2017-02-15 EP disclosed
US-20160003040-A1 Tracers Resman Technology AS (NO) 2016-01-07 US disclosed