SCHEMBL30933403

SCHEMBL30933403

CCC(O)Oc1cccc2c(OC(O)CC)cccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.37
NR2E1 Q9Y466 4/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
SLC6A4 P31645 4/20 0.35
SLC6A2 P23975 3/20 0.35
SLC6A3 Q01959 1/20 0.35
LMNA P02545 2/20 0.34
AGTR1 P30556 2/20 0.34
CYP2D6 P10635 3/20 0.34
ADRB2 P07550 2/20 0.34
ADRB1 P08588 2/20 0.34
ADRB3 P13945 2/20 0.34
HTR2A P28223 2/20 0.34
HTR2C P28335 2/20 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
SCHEMBL3610422 0.89 CYP1A2 (0.54) CYP1A2KDM4EMEN1CYP2C19KMT2A
Hydrochloric Acid SCHEMBL28443505 0.87 CYP1A2 (0.53) CYP1A2KDM4EMEN1CYP2C19KMT2A
SCHEMBL10591822 0.79 HTR1A (0.55) CYP1A2KDM4EMEN1KMT2ATSHR
SCHEMBL516178 0.78 CYP1A2 (0.49) CYP1A2KDM4EMEN1CYP2C19KMT2A
SCHEMBL2349413 0.78 TSHR (0.48) KDM4ETSHRLMNAALDH1A1
SCHEMBL11052422 0.77 TAS1R3 (0.41) CYP1A2CYP2C19KMT2ATSHRSLC6A4
SCHEMBL11253519 0.76 L3MBTL1 (0.46) CYP1A2KDM4ECYP2C19TSHRSLC6A4
SCHEMBL8717379 0.76 ALDH1A1 (0.37) LMNAADRB2ADRB1ALDH1A1DRD3
SCHEMBL16241822 0.76 KMT2A (0.43) CYP1A2MEN1CYP2C19KMT2ATSHR
SCHEMBL11053775 0.76 ALDH1A1 (0.46) CYP1A2MEN1CYP2C19KMT2ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108935-B Copolymerization type polycarbonate resin, preparation method and application thereof 中国科学院成都有机化学有限公司 2025-03-18 CN disclosed
CN-118108935-A Copolymerization type polycarbonate resin, preparation method and application thereof 中国科学院成都有机化学有限公司 2024-05-31 CN disclosed