SCHEMBL21799811

SCHEMBL21799811

CC(C)(C)CNCc1ccccc1CN

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNMT P11086 2/20 0.38
▸ CYP2D6 P10635 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ DPP4 P27487 2/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ CHEK1 O14757 1/20 0.34
▸ CA12 O43570 3/20 0.34
▸ CA2 P00918 3/20 0.34
▸ CHRM2 P08172 2/20 0.34
▸ PIM1 P11309 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL21799977 0.84 PNMT (0.38) PNMTCYP2D6TSHRHIF1ADPP4
SCHEMBL21799554 0.81 CHRM2 (0.40) TSHRCA12CA2CHRM2BCHE
SCHEMBL13900508 0.78 CHRM2 (0.56) GAAMEN1KMT2ACHRM2LMNA
SCHEMBL21799542 0.78 GAA (0.46) PNMTCYP2D6TSHRHIF1ADPP4
SCHEMBL23613102 0.77 L3MBTL1 (0.57) NPSR1GAAL3MBTL1MEN1KMT2A
SCHEMBL21800025 0.76 HTT (0.43) PNMTCYP2D6HIF1ADPP4GAA
SCHEMBL21799745 0.74 SLC6A4 (0.47) TSHRCA12CA2CHRM2BCHE
SCHEMBL12622720 0.74 MC5R (0.53) CYP2D6L3MBTL1MEN1KMT2ACA2
SCHEMBL30192689 0.74 CA12 (0.48) TSHRCA12CA2CHRM2SLC6A4
Iodide SCHEMBL28958724 0.73 PNMT (0.60) PNMTDPP4KDM4ETAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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