SCHEMBL31723247

SCHEMBL31723247

COc1cc(N(C)c2cc(C)cc(N)c2Cl)ccc1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
LMNA P02545 1/20 0.34
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
TUBB4A P04350 2/20 0.33
TUBB P07437 2/20 0.33
TUBA3C P0DPH7 2/20 0.33
TUBA1B P68363 2/20 0.33
TUBA4A P68366 2/20 0.33
TUBB4B P68371 2/20 0.33
TUBB3 Q13509 2/20 0.33
TUBB2A Q13885 2/20 0.33
TUBB8 Q3ZCM7 2/20 0.33
TUBA3E Q6PEY2 2/20 0.33
TUBA1A Q71U36 2/20 0.33
TUBA1C Q9BQE3 2/20 0.33
TUBB6 Q9BUF5 2/20 0.33

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
SCHEMBL22232420 1.00 ALDH1A1 (0.36) ALDH1A1CYP3A4LMNAMAPK13MAPK12
SCHEMBL29454270 1.00 ALDH1A1 (0.36) ALDH1A1CYP3A4LMNAMAPK13MAPK12
SCHEMBL22232093 0.90 TUBB1 (0.42) ALDH1A1CYP3A4LMNAMAPK13MAPK12
SCHEMBL29454233 0.90 TUBB1 (0.42) ALDH1A1CYP3A4LMNAMAPK13MAPK12
SCHEMBL31723191 0.85 MAPK13 (0.34) MAPK13MAPK12MAPK11MAPK14GAA
SCHEMBL29454096 0.85 MAPK13 (0.34) MAPK13MAPK12MAPK11MAPK14GAA
SCHEMBL22232065 0.82 TUBB4A (0.38) ALDH1A1CYP3A4TUBB4ATUBBTUBA3C
SCHEMBL29454087 0.82 TUBB4A (0.38) ALDH1A1CYP3A4TUBB4ATUBBTUBA3C
SCHEMBL22232378 0.79 SLC6A2 (0.35) MAPK13MAPK12MAPK11MAPK14SLC6A2
SCHEMBL29454090 0.79 SLC6A2 (0.35) MAPK13MAPK12MAPK11MAPK14SLC6A2

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
EP-4647426-A2 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI Industries Ltd. (IN) 2025-11-12 EP claimed