SCHEMBL25141380

SCHEMBL25141380

Nc1ccc(C(=O)Nc2ccc(-c3ccc(N)cc3C(F)(F)F)c(C(F)(F)F)c2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ PTGS1 P23219 3/20 0.51
▸ TMPRSS4 Q9NRS4 3/20 0.46
▸ PTPRC P08575 3/20 0.45
▸ TRPV1 Q8NER1 1/20 0.44
▸ HDAC1 Q13547 2/20 0.43
▸ GRM4 Q14833 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ CTSL P07711 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ CTSS P25774 1/20 0.42
▸ PTPN13 Q12923 1/20 0.42
▸ S1PR1 P21453 1/20 0.41
▸ S1PR3 Q99500 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
SCHEMBL25144421 0.94 PTGS1 (0.51) GLAPOLBGAATSHRPTGS1
SCHEMBL25143890 0.91 PTGS1 (0.52) POLBGAAPTGS1PTPRCRAB9A
SCHEMBL25143907 0.88 MAPT (0.47) PTGS1TRPV1NPC1RAB9A
SCHEMBL25141312 0.87 GLA (0.51) GLAPOLBGAATSHRPTGS1
SCHEMBL25141367 0.86 GLA (0.50) GLAPOLBGAATSHRPTGS1
SCHEMBL25143906 0.86 PTGS1 (0.53) GLAPOLBGAATSHRPTGS1
SCHEMBL25141347 0.86 PTGS1 (0.50) GLAPOLBGAATSHRPTGS1
SCHEMBL25141317 0.85 PTGS1 (0.56) GLAPOLBGAATSHRPTGS1
SCHEMBL24605877 0.84 PTGS1 (0.60) GLAPOLBGAATSHRPTGS1
SCHEMBL29751959 0.84 PTGS1 (0.60) GLAPOLBGAATSHRPTGS1

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-20230123199-A1 Diamine, Polymer and Film Produced Using the Same SK IE TECHNOLOGY CO., LTD. (KR) 2023-04-20 — — US disclosed
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