SCHEMBL19225131

SCHEMBL19225131

CC(C)c1cccc(CCN2C(=O)c3cccc4cccc(c34)C2=O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.66
▸ ALDH1A1 P00352 2/20 0.66
▸ SMN1; SMN2 Q16637 2/20 0.66
▸ GAA P10253 1/20 0.66
▸ MAPT P10636 1/20 0.66
▸ RAB9A P51151 1/20 0.66
▸ CA12 O43570 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ HEXA P06865 7/20 0.51
▸ HEXB P07686 7/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.50
▸ OGA O60502 1/20 0.50
▸ CYP1B1 Q16678 1/20 0.50
▸ POLB P06746 3/20 0.49
▸ NR1I2 O75469 1/20 0.49
▸ AHR P35869 1/20 0.49
▸ RAD52 P43351 1/20 0.49
▸ RCE1 Q9Y256 1/20 0.49

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
SCHEMBL22088658 0.86 ALDH1A1 (0.57) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL28284669 0.80 ALDH1A1 (1.00) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL23591529 0.76 KDM4E (0.66) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL20746622 0.75 ALDH1A1 (0.60) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL6272260 0.74 KEAP1 (0.65) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL29486056 0.72 CYP1B1 (0.73) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL1101932 0.72 CYP1B1 (0.73) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL12431367 0.72 RAB9A (0.55) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL12431368 0.72 ALDH1A1 (0.55) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL14590463 0.72 HEXA (0.65) KDM4EALDH1A1SMN1; SMN2GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3202855-A1 NEAR-INFRARED ABSORBING COMPOSITION, CURABLE COMPOSITION, CURED FILM, NEAR-INFRARED BLOCKING FILTER, SOLID-STATE IMAGING ELEMENT, INFRARED SENSOR, CAMERA MODULE, PROCESSED DYE AND METHOD FOR PRODUCING PROCESSED DYE FUJIFILM Corporation (JP) 2017-08-09 — — EP disclosed
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