SCHEMBL21446090

SCHEMBL21446090

CC(C)CC1(C(=O)OCc2ccccc2)CCC1C

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.41
HTR2C P28335 1/20 0.40
CTSK P43235 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
EP300 Q09472 1/20 0.39
HIF1A Q16665 1/20 0.39
CREBBP Q92793 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
SCHEMBL27655610 0.75 TSHR (0.42) ALDH1A1TSHRCTSKEP300HIF1A
SCHEMBL23848155 0.75 PPARG (0.44) ALDH1A1
SCHEMBL16347929 0.75 ALDH1A1 (0.45) DDB1CRBNALDH1A1
SCHEMBL27655612 0.74 KDM4E (0.41) EP300HIF1ACREBBP
SCHEMBL32674103 0.73 ALDH1A1 (0.53) DDB1CRBNALDH1A1TSHRHTR2C
SCHEMBL8260201 0.73 ALDH1A1 (0.46) DDB1CRBNALDH1A1CTSK
SCHEMBL23987261 0.73 ALDH1A1 (0.46) DDB1CRBNALDH1A1CTSK
SCHEMBL28404362 0.71 DDB1 (0.50) DDB1CRBNALDH1A1TSHRHTR2C
SCHEMBL18970149 0.71
SCHEMBL27655557 0.71 ADAM17 (0.40) ALDH1A1CTSKEP300HIF1ACREBBP

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
US-11117986-B2 Curable composition, film, optical filter, solid image pickup element, image display device, and infrared sensor FUJIFILM CORPORATION (JP) 2021-09-14 US disclosed
US-20190309106-A1 CURABLE COMPOSITION, FILM, OPTICAL FILTER, SOLID IMAGE PICKUP ELEMENT, IMAGE DISPLAY DEVICE, AND INFRARED SENSOR FUJIFILM CORPORATION (JP) 2019-10-10 US disclosed