SCHEMBL21799622

SCHEMBL21799622

CC(C)(C)CNc1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.46
NUDT1 P36639 2/20 0.43
IDH1 O75874 1/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
APP P05067 1/20 0.39
GHSR Q92847 1/20 0.39
MAPT P10636 4/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX12 P18054 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CA12 O43570 3/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA9 Q16790 3/20 0.38

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
SCHEMBL4615465 0.86 MAOA (0.39) MAPK8NUDT1MAOAMAOBAPP
Hydrochloric Acid SCHEMBL5418540 0.84 MAOA (0.38) MAPK8NUDT1MAOAMAOBAPP
SCHEMBL14594017 0.84 APP (0.38) MAPK8MAOAMAOBAPPMAPT
SCHEMBL6924125 0.84 MAPK8 (0.36) MAPK8NUDT1IDH1MAOAMAOB
SCHEMBL1636624 0.83 MAPT (0.39) MAPK8MAOAMAOBAPPMAPT
SCHEMBL21799681 0.83 MAPT (0.39) MAPK8NUDT1MAOAMAOBAPP
SCHEMBL6921714 0.81 LMNA (0.39) MAPK8MAOAMAOBAPPMAPT
SCHEMBL855240 0.79 MAPT (0.58) MAPTALDH1A1HTTL3MBTL1MEN1
SCHEMBL14253798 0.78 MAOA (0.37) MAOAMAOBAPPMAPTALDH1A1
SCHEMBL21800004 0.78 APP (0.44) MAPK8MAOAMAOBAPPMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3623398-B1 RESIN COMPOSITION COMPRISING A MODIFIED BLOCK COPOLYMER AND METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER ASAHI CHEMICAL IND (JP) 2024-08-28 EP disclosed
CN-110603273-B Modified block copolymer, method for producing modified block copolymer, and resin composition 旭化成株式会社 2022-10-14 CN disclosed
US-11124593-B2 Modified block copolymer, method for producing modified block copolymer, and resin composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-09-21 US disclosed
US-20200199282-A1 Modified Block Copolymer, Method for Producing Modified Block Copolymer, and Resin Composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-06-25 US disclosed
EP-3623398-A1 MODIFIED BLOCK COPOLYMER, METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER, AND RESIN COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2020-03-18 EP disclosed
CN-110603273-A Modified block copolymer, method for producing modified block copolymer, and resin composition 旭化成株式会社 2019-12-20 CN disclosed