SCHEMBL8304627

SCHEMBL8304627

CC(O)C#CCN1N=C(c2ccc(Cl)cc2)CCC1=O

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.57
TP53 P04637 6/20 0.51
MAPT P10636 1/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
LMNA P02545 2/20 0.45
THRB P10828 1/20 0.43

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
SCHEMBL8683409 0.86 RAB9A (0.53) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL8684798 0.85 RAB9A (0.54) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL8305754 0.83 TP53 (0.55) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL8300262 0.83 RAB9A (0.53) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL8300317 0.81 TP53 (0.53) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL8305229 0.81 TP53 (0.56) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL8686253 0.81 RAB9A (0.51) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL8304640 0.80 TP53 (0.52) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL11461627 0.79 RAB9A (0.57) RAB9ATP53MAPTMEN1KMT2A
SCHEMBL8685387 0.79 TP53 (0.51) RAB9ATP53MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0478195-B1 Dihydropyridazinones and pyridazinones as fungicides ROHM & HAAS (US) 1999-05-26 EP disclosed
US-5753642-A AGRICULTURE, MEDICINE ROHM AND HAAS COMPANY (US) 1998-05-19 US disclosed
US-5728698-A AGRICULTURAL USE, RICE, WHEAT ROHM AND HAAS COMPANY (US) 1998-03-17 US disclosed
US-5728694-A Dihydropyridazinones, pyridazinones and related compounds as fungicides ROHM AND HAAS COMPANY (US) 1998-03-17 US disclosed
US-5728715-A FOR MAMMALS, AGRICULTURE, RICE, WHEAT, TOMATOES ROHM AND HAAS COMPANY (US) 1998-03-17 US disclosed
US-5726162-A FOR CONTROLLING AGRICULTURAL AND MAMMALIAN FUNGAL DISEASES ROHM AND HAAS COMPANY (US) 1998-03-10 US disclosed
US-5726176-A FOR CONTROLLING AGRICULTURAL AND MAMMALIAN FUNGAL DISEASES ROHM AND HAAS COMPANY (US) 1998-03-10 US disclosed
US-5631254-A RICE; HUMAN INFECTIONS ROHM AND HAAS COMPANY (US) 1997-05-20 US disclosed
US-5552409-A PHYTOPATHOGENIC, RICE ROHM AND HAAS COMPANY (US) 1996-09-03 US disclosed
EP-0478195-A1 Dihydropyridazinones, pyridazinones and related compounds as fungicides ROHM AND HAAS COMPANY (US) 1992-04-01 EP disclosed