SCHEMBL11166295

SCHEMBL11166295

Cc1ccc(-c2ccccc2)c(NC(=S)NC(=O)c2ccccc2)c1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.67
▸ MAPT P10636 5/20 0.67
▸ SMN1; SMN2 Q16637 2/20 0.67
▸ GAA P10253 1/20 0.67
▸ ALOX12 P18054 1/20 0.67
▸ EPHX1 P07099 3/20 0.64
▸ NPC1 O15118 4/20 0.58
▸ RAB9A P51151 4/20 0.58
▸ NPSR1 Q6W5P4 2/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ RXFP1 Q9HBX9 1/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ POLB P06746 1/20 0.57
▸ LMNA P02545 2/20 0.56
▸ PDPK1 O15530 1/20 0.55
▸ AKT1 P31749 1/20 0.55
▸ CCR6 P51684 1/20 0.53

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
SCHEMBL11158661 0.85 NPC1 (0.67) ALDH1A1MAPTSMN1; SMN2GAAALOX12
SCHEMBL3050280 0.85 RAB9A (0.71) ALDH1A1MAPTSMN1; SMN2GAAALOX12
SCHEMBL5713568 0.85 ALDH1A1 (0.78) ALDH1A1MAPTSMN1; SMN2GAAALOX12
SCHEMBL11194030 0.85 ALDH1A1 (0.65) ALDH1A1MAPTSMN1; SMN2GAAALOX12
SCHEMBL3054870 0.85 ALDH1A1 (0.72) ALDH1A1MAPTSMN1; SMN2GAAALOX12
SCHEMBL11161487 0.84 EPHX1 (0.74) ALDH1A1MAPTEPHX1NPC1RAB9A
SCHEMBL3047510 0.83 EPHX1 (0.66) ALDH1A1MAPTSMN1; SMN2ALOX12EPHX1
SCHEMBL18340971 0.83 EPHX1 (0.65) ALDH1A1MAPTSMN1; SMN2GAAALOX12
SCHEMBL16030259 0.82 EPHX1 (0.64) ALDH1A1MAPTSMN1; SMN2GAAALOX12
SCHEMBL16119683 0.81 EPHX1 (0.81) ALDH1A1MAPTSMN1; SMN2GAAALOX12

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-0017484-B1 2-IMIDAZOLINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THE PHARMACEUTICAL COMPOSITION OF THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-04-06 — — EP disclosed
EP-0017484-A1 2-Imidazoline derivatives, process for the preparation thereof and the pharmaceutical composition of the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-10-15 — — EP disclosed
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