SCHEMBL9003763

SCHEMBL9003763

C=Cc1cc(C(C)(C)c2ccc(O)c(C(=O)O)c2)ccc1OCCOc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.45
KDM4E B2RXH2 10/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
POLB P06746 4/20 0.41
CASP6 P55212 1/20 0.41
GAA P10253 2/20 0.41
MCL1 Q07820 1/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
RAB9A P51151 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
THRB P10828 1/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.38
APP P05067 1/20 0.37
PKM P14618 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL9003299 0.87 ALDH1A1 (0.49) ALDH1A1KDM4ESMN1; SMN2POLBCASP6
SCHEMBL9003392 0.87 ALDH1A1 (0.43) ALDH1A1KDM4ESMN1; SMN2POLBCASP6
SCHEMBL8973123 0.85 KDM4E (0.52) ALDH1A1KDM4ESMN1; SMN2POLBGAA
SCHEMBL9003307 0.85 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2POLBCASP6
SCHEMBL9003613 0.85 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2POLBCASP6
SCHEMBL9003606 0.85 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2POLBCASP6
SCHEMBL9003510 0.83 MCL1 (0.50) ALDH1A1KDM4ESMN1; SMN2POLBGAA
SCHEMBL9003245 0.82 ALDH1A1 (0.52) ALDH1A1KDM4ESMN1; SMN2POLBCASP6
SCHEMBL9003407 0.82 ALDH1A1 (0.44) ALDH1A1KDM4ESMN1; SMN2POLBCASP6
SCHEMBL7759210 0.82 KDM4E (0.49) ALDH1A1KDM4ESMN1; SMN2POLBGAA

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