SCHEMBL9003376

SCHEMBL9003376

CC(C)(c1ccc(OCCOc2ccccc2)cc1)c1cc(Br)c(O)c(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.48
POLB P06746 3/20 0.48
ALDH1A1 P00352 9/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
GAA P10253 2/20 0.46
LMNA P02545 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
PKM P14618 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
CYP3A4 P08684 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
SCHEMBL9003455 0.88 KDM4E (0.50) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL9003340 0.86 KDM4E (0.48) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL9003553 0.85 KMT2A (0.47) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL9003457 0.85 KDM4E (0.47) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL8973123 0.83 KDM4E (0.52) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL9003533 0.81 KDM4E (0.49) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL9003477 0.80 KDM4E (0.43) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL9003542 0.80 KDM4E (0.52) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL7759210 0.80 KDM4E (0.49) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL9003579 0.79 KDM4E (0.53) KDM4EPOLBALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0424914-B1 Recording material NEW OJI PAPER CO LTD (JP) 1996-09-25 EP disclosed
US-5276001-A Color developer comprising salicylic acid derivative KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-01-04 US disclosed
US-5096872-A Colorless basic dye reacts with salicylic acid derivative to form colored image, paper KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1992-03-17 US disclosed
EP-0424914-A2 Recording material NEW OJI PAPER CO., LTD. (JP) 1991-05-02 EP disclosed