SCHEMBL8911504

SCHEMBL8911504

COC1CCN(c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MBTD1 Q05BQ5 1/20 0.52
L3MBTL3 Q96JM7 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
RORC P51449 1/20 0.48
CHRNA7 P36544 3/20 0.47
MAPK1 P28482 2/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
CHRNB2 P17787 1/20 0.47
NFKB1 P19838 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA4 P43681 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
APOBEC3A P31941 1/20 0.46
PMP22 Q01453 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46

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
Hydrochloric Acid SCHEMBL29224139 0.98 MBTD1 (0.50) MBTD1L3MBTL3L3MBTL1RORCCHRNA7
SCHEMBL13486520 0.89 NOTUM (0.50) MBTD1L3MBTL3L3MBTL1RORCGPR119
SCHEMBL20760976 0.83 GRIN2B (0.59) MBTD1L3MBTL3L3MBTL1GRIN2BDRD3
SCHEMBL171731 0.82 ADRB1 (0.50) L3MBTL3L3MBTL1RORCMEN1KMT2A
SCHEMBL998038 0.82 RORC (0.39) MBTD1L3MBTL3L3MBTL1RORCSIGMAR1
SCHEMBL12093605 0.81 LMNA (0.48) MAPK1MEN1POLBKMT2ASMN1; SMN2
SCHEMBL293214 0.81 HTR3E (0.48) MAPK1MEN1KMT2ASIGMAR1HTR3E
SCHEMBL5225773 0.81 RORC (0.41) L3MBTL3L3MBTL1RORCKMT2ASIGMAR1
SCHEMBL18232039 0.81 CHKA (0.53) CYP3A4HIF1AOGACYP2D6HRH3
SCHEMBL2450915 0.81 MAPT (0.53) L3MBTL3L3MBTL1RORCMAPK1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598798-A Preparation method for directly synthesizing arylamine compound based on aromatic hydrocarbon and fatty amine 沈阳药科大学 2024-09-06 CN disclosed
CN-118146234-A 6,5,7,6-Tetracyclic derivatives, preparation method and application thereof 浙江我武翼方药业有限公司 2024-06-07 CN disclosed
WO-2023220541-A1 TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES COMPOUNDS AS HPK1 INHIBITORS MERCK PATENT GMBH (DE) 2023-11-16 WO disclosed
EP-2426125-B1 1,4 disubstituted 3 cyano pyridone derivatives and their use as positive allosteric modulators of mGluR2 receptors JANSSEN PHARMACEUTICALS INC (US) 2015-12-02 EP disclosed
CN-102026961-A Amide compound ASTELLAS PHARMA INC 2011-04-20 CN disclosed
CN-1738798-A Indole derivatives as somatostatin agonists or antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-02-22 CN disclosed
US-5625046-A Hydroxyl projecting groups for organic synthesis KING'S COLLEGE LONDON (GB) 1997-04-29 US disclosed
US-5436331-A Etherification with N-aryl-4-alkoxy-1,2,5,6-tetrahydropyidine KINGS COLLEGE LONDON (GB) 1995-07-25 US disclosed
EP-0298982-B1 PROTECTING GROUPS FOR ORGANIC SYNTHESIS KING'S COLLEGE LONDON (GB) 1991-08-28 EP disclosed