SCHEMBL7720244

SCHEMBL7720244

COC(=O)c1cc(-c2ccc(OC)cc2)nn(Cc2ccc(N)cc2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
HDAC1 Q13547 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 1/20 0.46
ADORA2A P29274 1/20 0.45
PLA2G2A P14555 2/20 0.45
ASIC1 P78348 1/20 0.44
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
GABRG2 P18507 2/20 0.43
GABRB3 P28472 2/20 0.43
GABRA3 P34903 2/20 0.43
GABRA1 P14867 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA2 P47869 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
SCHEMBL7720271 0.89 MAPT (0.64) MAPTHDAC1SMN1; SMN2MEN1KMT2A
SCHEMBL7726400 0.86 MAPT (0.68) MAPTHDAC1SMN1; SMN2MEN1KMT2A
SCHEMBL7720344 0.83 PLA2G2A (0.51) MAPTSMN1; SMN2PLA2G2AKDM4ECYP1A2
SCHEMBL7723619 0.82 KMT2A (0.54) MAPTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL7723532 0.81 GABRG2 (0.49) MAPTSMN1; SMN2PLA2G2AKDM4ECYP1A2
SCHEMBL30944683 0.81 NPBWR1 (0.47) SMN1; SMN2KDM4ECYP1A2CYP2C19GABRG2
SCHEMBL7724840 0.81 MAPT (0.61) MAPTHDAC1SMN1; SMN2KMT2APOLB
SCHEMBL7723670 0.80 MAPT (0.63) MAPTHDAC1SMN1; SMN2MEN1KMT2A
SCHEMBL7724966 0.80 MAPT (0.76) MAPTSMN1; SMN2POLBADORA2AKDM4E
SCHEMBL7730130 0.79 PLA2G2A (0.47) MAPTSMN1; SMN2PLA2G2AKDM4ECYP1A2

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
US-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 US disclosed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 EP disclosed