SCHEMBL3390607

SCHEMBL3390607

O=c1[nH]nncc1-c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.45
CHEK1 O14757 1/20 0.44
KDM4E B2RXH2 5/20 0.43
LMNA P02545 4/20 0.43
POLB P06746 2/20 0.43
HIF1A Q16665 2/20 0.43
CYP1A2 P05177 1/20 0.43
CCR1 P32246 1/20 0.43
CCR5 P51681 1/20 0.43
CCR8 P51685 1/20 0.43
METAP1 P53582 1/20 0.43
BLM P54132 1/20 0.43
DOHH Q9BU89 1/20 0.43
P4HTM Q9NXG6 1/20 0.43
TGFBR1 P36897 2/20 0.41
PRKCI P41743 1/20 0.41
HTT P42858 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TDP1 Q9NUW8 2/20 0.41

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
SCHEMBL3753128 0.75 PRKCI (0.47) BTKCHEK1KDM4ELMNAPOLB
SCHEMBL7413704 0.74 AKT1 (0.41) BTKLMNACYP1A2L3MBTL1ALDH1A1
SCHEMBL503719 0.74 KDM4E (0.50) BTKKDM4ELMNAPOLBHIF1A
SCHEMBL14446919 0.70 BTK (0.46) BTKCHEK1KDM4ELMNAPOLB
SCHEMBL14847366 0.69 NPY5R (0.46) KDM4ELMNAPOLBHIF1ACYP1A2
SCHEMBL26259950 0.68 KDM4E (0.65) KDM4ELMNAPOLBHIF1ACYP1A2
SCHEMBL2096438 0.68 PRKCI (0.47) BTKCHEK1KDM4ELMNAPOLB
SCHEMBL858806 0.68 KDM4E (0.72) KDM4ELMNAPOLBHIF1ACYP1A2
Dipyridyl SCHEMBL391569 0.67 KDM4E (0.93) KDM4ELMNAPOLBHIF1ACYP1A2
Dipyridyl SCHEMBL31695013 0.67 KDM4E (0.93) KDM4ELMNAPOLBHIF1ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4081267-A FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-03-28 US claimed
US-4033752-A FUNGICIDES, HERBICIDES SUMITOMO CHEMICAL COMPANY, LTD. (JA) 1977-07-05 US claimed
EP-2010514-B1 3-(PYRIDIN-2-YL)-[1,2,4]-TRIAZINES FOR USE AS FUNGICIDES BASF SE (DE) 2010-12-29 EP disclosed
US-5446163-A Reacting an iminomethylpyridyl with hydrazide compound in presence of protonic or Lewis acid catalyst REILLY INDUSTRIES, INC. (US) 1995-08-29 US disclosed
WO-1994007871-A1 PREPARATION OF HYDRAZONES, DIHYDROTHIADIAZOLES AND TRIAZINONES REILLY INDUSTRIES, INC. (US) 1994-04-14 WO disclosed
EP-0030038-B1 1,2,4-TRIAZINE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-10-05 EP disclosed
US-4081267-A FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-03-28 US disclosed
US-4081267-A FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-03-28 US disclosed
US-4081267-A FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-03-28 US disclosed
US-4033752-A FUNGICIDES, HERBICIDES SUMITOMO CHEMICAL COMPANY, LTD. (JA) 1977-07-05 US disclosed
US-4033752-A FUNGICIDES, HERBICIDES SUMITOMO CHEMICAL COMPANY, LTD. (JA) 1977-07-05 US disclosed
US-4033752-A FUNGICIDES, HERBICIDES SUMITOMO CHEMICAL COMPANY, LTD. (JA) 1977-07-05 US disclosed