SCHEMBL10501631

SCHEMBL10501631

S=c1c2cc(Cl)ccc2[se]n1-c1ccccn1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 2/20 0.38
▸ ALDH1A1 P00352 4/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ AGTR1 P30556 1/20 0.36
▸ PDCD1 Q15116 1/20 0.36
▸ CD274 Q9NZQ7 1/20 0.36
▸ DPP4 P27487 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ METAP2 P50579 1/20 0.34
▸ MARS1 P56192 1/20 0.34

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
SCHEMBL10502531 0.89 MAT2A (0.40) MAT2AALDH1A1MAPTKDM4ELMNA
SCHEMBL10501557 0.84 CD274 (0.34) MAT2AALDH1A1MAPTKDM4ELMNA
SCHEMBL10743453 0.84 METAP2 (0.34) MAT2AALDH1A1MAPTKDM4EAGTR1
SCHEMBL5916634 0.83 METAP2 (0.45) MAT2AALDH1A1MAPTKDM4ELMNA
SCHEMBL10502474 0.82 ALDH1A1 (0.38) ALDH1A1MAPTKDM4ELMNAHTT
SCHEMBL10501980 0.80 METAP2 (0.41) ALDH1A1MAPTKDM4ELMNAHTT
SCHEMBL10501411 0.79 METAP2 (0.38) MAT2AALDH1A1MAPTKDM4ELMNA
SCHEMBL10502370 0.78 KMT2A (0.42) ALDH1A1MAPTKDM4ELMNA
SCHEMBL10502151 0.78 METAP2 (0.44) MAT2AALDH1A1MAPTKDM4ELMNA
SCHEMBL10502337 0.75 ALDH1A1 (0.38) ALDH1A1MAPTKDM4ELMNAHTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0154851-B1 BENZISOSELENAZOLETHIONES,PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PRODUCTS CONTAINING THESE COMPOUNDS A. Nattermann & Cie. GmbH (DE) 1989-08-02 — — EP disclosed
US-4711961-A Benzisoselenazolethiones and process for the treatment of various diseases in humans A. NATTERMANN & CIE GMBH (DE) 1987-12-08 — — US disclosed
EP-0154851-A1 Benzisoselenazolethiones,process for their preparation and pharmaceutical products containing these compounds A. Nattermann & Cie. GmbH (DE) 1985-09-18 — — EP disclosed
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