SCHEMBL21630427

SCHEMBL21630427

CC(C)(C)c1cc(C2CCCCCCCCCCC2)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.53
ATM Q13315 1/20 0.49
ALDH1A1 P00352 3/20 0.48
ALOX15 P16050 2/20 0.48
NR1I2 O75469 1/20 0.48
LMNA P02545 1/20 0.48
CYP2C9 P11712 1/20 0.48
MIF P14174 1/20 0.48
TYR P14679 1/20 0.48
HTT P42858 1/20 0.48
NFE2L2 Q16236 1/20 0.48
HSD17B10 Q99714 1/20 0.48
QDPR P09417 4/20 0.44
HDAC4 P56524 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
NR1H4 Q96RI1 2/20 0.42
CYP1A2 P05177 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL156312 1.00 ACMSD (0.53) ACMSDATMALDH1A1ALOX15NR1I2
SCHEMBL3009268 0.98 ACMSD (0.51) ACMSDATMALDH1A1ALOX15NR1I2
SCHEMBL8711457 0.87 ATM (0.45) ACMSDATMALDH1A1ALOX15NR1I2
SCHEMBL3809639 0.85 CYP2C9 (0.56) ATMALDH1A1ALOX15NR1I2LMNA
SCHEMBL3807478 0.85 CYP2C9 (0.56) ATMALDH1A1ALOX15NR1I2LMNA
SCHEMBL2718010 0.85 CYP2C9 (0.56) ATMALDH1A1ALOX15NR1I2LMNA
SCHEMBL11702374 0.84 ACMSD (0.47) ACMSDATMALDH1A1ALOX15NR1I2
SCHEMBL9008164 0.84 ALDH1A1 (0.50) ACMSDATMALDH1A1ALOX15NR1I2
SCHEMBL11743772 0.83 ACMSD (0.53) ACMSDQDPRHDAC4HDAC2HDAC8
SCHEMBL27459435 0.81 ACMSD (0.51) ACMSDQDPRHDAC4HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113166029-B Process for preparing carbonate derivatives 国立大学法人神户大学 2023-11-21 CN disclosed
CN-113166392-B Process for the preparation of polycarbonates 国立大学法人神户大学 2023-07-14 CN disclosed
CN-112449645-B Polycarbonate resin and method for producing same 三菱瓦斯化学株式会社 2022-09-23 CN disclosed
CN-114423804-A Polycarbonate resin, method for producing same, polycarbonate resin composition, and molded article 三菱瓦斯化学株式会社 2022-04-29 CN disclosed
CN-113439099-A Polycarbonate resin composition and optical lens using same 三菱瓦斯化学株式会社 2021-09-24 CN disclosed
CN-113227200-A Thermoplastic resin composition and optical component using the same 三菱瓦斯化学株式会社 2021-08-06 CN disclosed
CN-113166392-A Process for the preparation of polycarbonates 国立大学法人神户大学 2021-07-23 CN disclosed
CN-113166029-A Process for producing carbonate derivative 国立大学法人神户大学 2021-07-23 CN disclosed
WO-2021054258-A1 POLYCARBONATE RESIN, METHOD FOR PRODUCING SAME, POLYCARBONATE RESIN COMPOSITION AND MOLDED BODY 三菱瓦斯化学株式会社 2021-03-25 WO disclosed
CN-112449645-A Polycarbonate resin and method for producing same 三菱瓦斯化学株式会社 2021-03-05 CN disclosed
WO-2020022130-A1 POLYCARBONATE RESIN AND METHOD FOR PRODUCING SAME 三菱瓦斯化学株式会社 2020-01-30 WO disclosed