SCHEMBL21799747

SCHEMBL21799747

CCCNC(CN)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.46
TAAR1 Q96RJ0 4/20 0.45
HTR2A P28223 3/20 0.45
MTOR P42345 1/20 0.42
RAB9A P51151 1/20 0.42
GRM7 Q14831 1/20 0.42
CYP3A4 P08684 3/20 0.41
ALOX15 P16050 2/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
AOC3 Q16853 1/20 0.40
KCNN4 O15554 1/20 0.39
KCNA5 P22460 1/20 0.39
CHRM2 P08172 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39

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
SCHEMBL21799461 0.89 ALDH1A1 (0.53) TAAR1HTR2AALDH1A1POLBMAPT
SCHEMBL21799476 0.87 HTR2A (0.47) SIGMAR1TAAR1HTR2AALDH1A1POLB
SCHEMBL21799549 0.86 HTR2A (0.50) SIGMAR1TAAR1HTR2AALDH1A1POLB
SCHEMBL21799802 0.86 HTR2A (0.50) SIGMAR1TAAR1HTR2AALDH1A1POLB
SCHEMBL11626763 0.86 HTR2A (0.50) SIGMAR1TAAR1HTR2AALDH1A1POLB
SCHEMBL21799659 0.86 HTR2A (0.50) SIGMAR1TAAR1HTR2AALDH1A1POLB
SCHEMBL21799658 0.86 HTR2A (0.50) SIGMAR1TAAR1HTR2AALDH1A1POLB
SCHEMBL21799652 0.86 HTR2A (0.50) SIGMAR1TAAR1HTR2AALDH1A1POLB
SCHEMBL21799711 0.86 HTR2A (0.50) SIGMAR1TAAR1HTR2AALDH1A1POLB
SCHEMBL11622496 0.84 TAAR1 (0.48) SIGMAR1TAAR1HTR2AMTORRAB9A

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 4 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