SCHEMBL10975490

SCHEMBL10975490

COC(=O)CCCCn1nnnc1C

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
TSHR P16473 3/20 0.42
KAT2B Q92831 3/20 0.40
GHSR Q92847 1/20 0.39
P2RX7 Q99572 1/20 0.39
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
MIF P14174 1/20 0.36
FAAH O00519 1/20 0.36
DYRK1A Q13627 2/20 0.36

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
SCHEMBL10971190 0.95 MAPK1 (0.51) MAPK1TSHRKAT2BGHSRP2RX7
SCHEMBL10974169 0.82 MAPK1 (0.46) MAPK1TSHRP2RX7ALDH1A1LMNA
SCHEMBL13631407 0.78 MAPK1 (0.72) MAPK1TSHRALDH1A1LMNA
SCHEMBL10968077 0.77 KDM4E (0.50) MAPK1TSHRP2RX7ALDH1A1LMNA
SCHEMBL10969467 0.76 HTT (0.51) MAPK1TSHRP2RX7ALDH1A1LMNA
SCHEMBL10972067 0.75 HSD11B1 (0.60) GHSRP2RX7ALDH1A1FAAH
SCHEMBL10971909 0.74 TLR7 (0.39) MAPK1TSHRGHSRLMNAMIF
SCHEMBL7499343 0.73 CA12 (0.38)
SCHEMBL2088514 0.72 P2RX7 (0.46) MAPK1P2RX7ALDH1A1LMNA
SCHEMBL10677984 0.72 TSHR (0.42) TSHRKAT2BALDH1A1LMNAMIF

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-0035228-B1 TETRAZOLE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, AND ANTI-ULCER COMPOSITION CONTAINING THE SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-01-02 EP disclosed
US-4372953-A Tetrazole derivatives, and anti-ulcer composition containing the same OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1983-02-08 US disclosed
EP-0035228-A1 Tetrazole derivatives, process for the preparation thereof, and anti-ulcer composition containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1981-09-09 EP disclosed