SCHEMBL19338014

SCHEMBL19338014

Cc1ccccccc(C)[nH]1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HMBS P08397 1/20 0.67
▸ TSHR P16473 2/20 0.47
▸ ACHE P22303 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ AHR P35869 1/20 0.36
▸ MAPK8 P45983 1/20 0.36
▸ GAA P10253 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ PARP1 P09874 1/20 0.34
▸ TNKS2 Q9H2K2 1/20 0.34
▸ TP53 P04637 1/20 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
SCHEMBL65952 0.81 — —
SCHEMBL23572345 0.78 CA1 (0.48) HMBSAHRGAAKDM4ECYP1A2
SCHEMBL28896011 0.77 HMBS (0.92) HMBSACHELMNAMAPK8GAA
SCHEMBL6561706 0.77 — —
SCHEMBL8208273 0.77 HMBS (0.92) HMBSACHELMNAMAPK8GAA
SCHEMBL8619374 0.77 — —
SCHEMBL22537619 0.74 MEN1 (0.41) HMBSLMNAL3MBTL1MAPK8KDM4E
SCHEMBL21763586 0.72 HMBS (0.48) HMBSTSHRACHEL3MBTL1AHR
SCHEMBL28975482 0.71 FKBP5 (0.43) HMBSTSHRACHELMNAALOX12
Toluene SCHEMBL10976206 0.65 ACHE (1.00) TSHRACHELMNAALOX12CYP1A2

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-2902489-B1 FGFR3 FUSION GENE AND PHARMACEUTICAL DRUG TARGETING SAME CHUGAI PHARMACEUTICAL CO LTD (JP) 2017-09-13 — — EP disclosed
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