SCHEMBL3363375

SCHEMBL3363375

CN(C)c1ccc(/C=C/C(=O)n2ccnc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.54
MAPT P10636 5/20 0.50
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALOX15 P16050 1/20 0.47
CASP1 P29466 1/20 0.47
HBB P68871 1/20 0.47
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
TLR9 Q9NR96 1/20 0.46
MAOB P27338 2/20 0.44
MAOA P21397 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GPR183 P32249 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC4 P56524 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
SCHEMBL23285244 0.84 MAOB (0.56) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL22416556 0.82 TYR (0.49) KMT2AMEN1RAB9ATLR9MAOB
SCHEMBL4715046 0.81 MAOB (0.56) MAPTKMT2AMEN1MAOBMAOA
SCHEMBL1186024 0.81 CYP24A1 (0.54) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL5201692 0.81 CYP24A1 (0.54) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL16765774 0.81 CYP1A2 (0.55) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL21181012 0.81 MAOB (0.59) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL14375119 0.81 CYP1A2 (0.55) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL18374565 0.77 CYP24A1 (0.46) KMT2AMEN1NPC1RAB9AMAOB
SCHEMBL6270359 0.76 ACHE (0.52) MAPTKMT2AMEN1MAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3613808-B1 HIGH DIELECTRIC INSULATING SILICONE RUBBER COMPOSITION AND ELECTRIC FIELD RELAXATION LAYER SHINETSU CHEMICAL CO (JP) 2024-06-19 EP disclosed
US-11610698-B2 Electric wire, cable, and manufacturing method of electric wire HITACHI METALS, LTD. (JP) 2023-03-21 US disclosed
US-11434345-B2 High dielectric insulating silicone rubber composition and electric field relaxation layer SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-09-06 US disclosed
CN-111278925-B Kneading silicone rubber composition and electric field relaxation layer 信越化学工业株式会社 2022-04-19 CN disclosed
US-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PTE. LTD. (SG) 2010-01-14 US disclosed
US-20080161324-A1 Compositions and methods for treatment of viral diseases EXCRX (SINGAPORE) PTE. LTD. (F.K.A. COMBINATORX (SINGAPORE) PTE LTD.) (SG) 2008-07-03 US disclosed
WO-2008033466-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PRE. LTD. (SG) 2008-03-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES HTR1A, HTR3B, HTR3A HSD17B3 809/4885MAPT 1527/4885KMT2A 1108/4885
US-20080161324-A1 Compositions and methods for treatment of viral diseases HAVCR2, EIF2AK2, RNASE1 HSD17B3 654/4885MAPT 3341/4885KMT2A 2353/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.