SCHEMBL10688478

SCHEMBL10688478

O=C1CCC(c2cccc(Br)c2)=NN1CN1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 2/20 0.49
▸ PGR P06401 2/20 0.42
▸ PRKDC P78527 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ HTT P42858 1/20 0.41
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CHRNB4 P30926 1/20 0.37
▸ CHRNA3 P32297 1/20 0.37
▸ APC P25054 2/20 0.37
▸ LMNA P02545 1/20 0.37

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
SCHEMBL10685754 0.89 PGR (0.46) PDE4DPGRALDH1A1HTTMEN1
SCHEMBL10684724 0.80 PGR (0.44) PDE4DPGRALDH1A1MEN1KMT2A
SCHEMBL10683151 0.75 PDE4D (0.50) PDE4DPGRALDH1A1HTTMEN1
SCHEMBL10691334 0.71 TSHR (0.47) PRKDCCNR1CNR2ALDH1A1HTT
SCHEMBL16899734 0.64 KCNH2 (0.52) CNR1CNR2POLB
SCHEMBL8302888 0.63 PGR (0.46) PDE4DPGRALDH1A1MEN1KMT2A
SCHEMBL578335 0.63 SMN1; SMN2 (0.70) CNR1CNR2ALDH1A1HTT
SCHEMBL6818232 0.62 SMN1; SMN2 (0.68) CNR1CNR2ALDH1A1HTT
SCHEMBL17160816 0.62 SMN1; SMN2 (0.68) CNR1CNR2ALDH1A1HTT
SCHEMBL11735535 0.62 SMN1; SMN2 (0.67) PDE4DPDE4APDE4BPDE4CPDE3B

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
US-4738961-A FUNGICIDES SANKYO COMPANY, LIMITED (JP) 1988-04-19 — — US disclosed
EP-0072238-B1 PYRIDAZINONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN AGRICULTURAL COMPOSITIONS AND THE TREATMENT OF SEED AND PLANTS SANKYO COMPANY LIMITED (JP) 1985-11-06 — — EP disclosed
EP-0072238-A1 Pyridazinone derivatives, their preparation and their use in agricultural compositions and the treatment of seed and plants SANKYO COMPANY LIMITED (JP) 1983-02-16 — — EP disclosed
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