SCHEMBL11166320

SCHEMBL11166320

N#Cc1ccc(Oc2ccccc2NC(N)=S)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2C P18825 1/20 0.47
▸ CACNA1B Q00975 5/20 0.46
▸ SLC6A4 P31645 1/20 0.45
▸ PARP15 Q460N3 1/20 0.44
▸ PARP10 Q53GL7 1/20 0.44
▸ PARP2 Q9UGN5 1/20 0.44
▸ MEN1 O00255 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ PKM P14618 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ IL18 Q14116 1/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ALOX12 P18054 3/20 0.42

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
SCHEMBL11164984 0.83 MAPT (0.46) ADRA2CMEN1MAPTKMT2APKM
SCHEMBL7815135 0.83 ADRA2C (0.59) ADRA2CMEN1MAPTKMT2APKM
SCHEMBL11160995 0.82 CACNA1H (0.49) ADRA2CCACNA1BPARP10MEN1MAPT
SCHEMBL11158176 0.81 NPSR1 (0.57) ADRA2CSLC6A4MEN1MAPTKMT2A
SCHEMBL11163188 0.81 L3MBTL1 (0.53) ADRA2CSLC6A4MEN1MAPTKMT2A
SCHEMBL11164283 0.81 ADRA2C (0.47) ADRA2CSLC6A4MEN1MAPTKMT2A
SCHEMBL11160894 0.80 EPHX1 (0.55) ADRA2CMEN1MAPTKMT2AKDM4E
SCHEMBL11165605 0.77 ALDH1A1 (0.51) ADRA2CCACNA1BMEN1MAPTKMT2A
SCHEMBL28558177 0.76 ALDH1A1 (0.53) PARP15PARP10PARP2MEN1MAPT
Iodide SCHEMBL11157435 0.76 CACNA1B (0.45) ADRA2CCACNA1BSLC6A4MEN1MAPT

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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