SCHEMBL21799704

SCHEMBL21799704

CCCC(C)CNC(CN)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 13/20 0.48
TAAR1 Q96RJ0 4/20 0.43
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
AOC3 Q16853 2/20 0.41
HTR2A P28223 1/20 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
SCHEMBL21799752 0.87 GPR88 (0.46) GPR88TAAR1AOC3HTR2A
SCHEMBL21799526 0.81 TAAR1 (0.50) TAAR1HTTAOC3HTR2A
SCHEMBL21799538 0.78 TAAR1 (0.42) GPR88TAAR1AOC3HTR2A
SCHEMBL21799468 0.78 TAAR1 (0.48) GPR88TAAR1HTTAOC3HTR2A
SCHEMBL21799747 0.78 SIGMAR1 (0.46) GPR88TAAR1MAPTHTTAOC3
SCHEMBL28855180 0.77 CYP3A4 (0.45) GPR88TAAR1HTTAOC3HTR2A
SCHEMBL21799489 0.77 CYP3A4 (0.45) GPR88TAAR1HTTAOC3HTR2A
SCHEMBL26472298 0.77 TAAR1 (0.48) GPR88TAAR1AOC3HTR2A
SCHEMBL11622496 0.77 TAAR1 (0.48) GPR88TAAR1AOC3HTR2A
SCHEMBL21799759 0.77 TAAR1 (0.46) GPR88TAAR1AOC3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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