SCHEMBL7992979

SCHEMBL7992979

CC1(C)C2CCC1(C)C(Oc1ccc(C(=O)O)cc1)C2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
MAPK1 P28482 2/20 0.57
KMT2A Q03164 2/20 0.57
CYP2C19 P33261 1/20 0.50
MEN1 O00255 1/20 0.48
CYP19A1 P11511 2/20 0.47
ELANE P08246 2/20 0.44
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
XBP1 P17861 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
SCN9A Q15858 2/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41

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
SCHEMBL11585379 0.83 MAPT (0.63) MAPTMAPK1KMT2ACYP2C19MEN1
SCHEMBL10409063 0.83 CYP2C19 (0.53) MAPTMAPK1KMT2ACYP2C19MEN1
SCHEMBL10409062 0.83 CYP2C19 (0.53) MAPTMAPK1KMT2ACYP2C19MEN1
Benzoic Acid SCHEMBL11307241 0.79 CYP2C19 (0.60) MAPTMAPK1KMT2ACYP2C19MEN1
Borneol SCHEMBL28793592 0.79 CA1 (0.51) MAPTMAPK1KMT2ACYP2C19MEN1
Terephthalic Acid SCHEMBL31540151 0.79 KMT2A (0.50) MAPTMAPK1KMT2ACYP2C19MEN1
Terephthalic Acid SCHEMBL31454019 0.79 KMT2A (0.50) MAPTMAPK1KMT2ACYP2C19MEN1
SCHEMBL31540152 0.77 MAPT (0.89) MAPTMAPK1KMT2ACYP2C19MEN1
SCHEMBL2913021 0.77 MAPT (0.46) MAPTMAPK1KMT2ACYP2C19MEN1
SCHEMBL2921356 0.77 CYP19A1 (0.45) MAPTMAPK1KMT2ACYP2C19MEN1

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
EP-0982621-B1 Film for optical elements NIPPON MITSUBISHI OIL CORP (JP) 2012-10-10 EP disclosed
US-6294229-B1 Film for optical elements NIPPON MITSUBISHI OIL COMPANY (JP) 2001-09-25 US disclosed
EP-0982621-A2 Film for optical elements Nippon Mitsubishi Oil Corporation (JP) 2000-03-01 EP disclosed