SCHEMBL9305532

SCHEMBL9305532

O=C(O)c1cccc(OCCOc2ccccc2)c1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.76
KMT2A Q03164 4/20 0.59
MEN1 O00255 3/20 0.59
PTK2B Q14289 1/20 0.58
PKM P14618 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.48
KDM4E B2RXH2 3/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.48
HPGD P15428 1/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPT P10636 4/20 0.47
LMNA P02545 4/20 0.47
POLB P06746 1/20 0.47
CASP6 P55212 1/20 0.47
PARP10 Q53GL7 1/20 0.46

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
SCHEMBL10600408 0.88 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1PTK2BPKM
SCHEMBL2452436 0.86 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1PTK2BPKM
SCHEMBL10696284 0.83 ALDH1A1 (0.53) ALDH1A1KMT2APTK2BL3MBTL1KDM4E
SCHEMBL4963086 0.82 ALDH1A1 (0.51) ALDH1A1KMT2AMEN1PTK2BKDM4E
SCHEMBL2450380 0.81 ALDH1A1 (0.90) ALDH1A1KMT2AMEN1PTK2BPKM
SCHEMBL2451111 0.81 ALDH1A1 (0.90) ALDH1A1KMT2AMEN1PTK2BPKM
SCHEMBL4960309 0.81 KMT2A (0.51) ALDH1A1KMT2AMEN1PTK2BKDM4E
SCHEMBL3661217 0.81 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1PTK2BKDM4E
SCHEMBL28082149 0.79 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1PTK2BPKM
SCHEMBL7050350 0.79 PTGER1 (0.61) ALDH1A1KMT2AMEN1L3MBTL1SMN1; SMN2

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
US-5276001-A Color developer comprising salicylic acid derivative KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-01-04 US disclosed
US-4839332-A AMINO-SUBSTITUTED FLUORENE AND ACID; DISCOLORATION INHIBITON, CHEMICAL RESISTANCE FUJI PHOTO FILM CO., LTD. (JP) 1989-06-13 US disclosed
EP-0275203-A2 Heat-sensitive recording material containing color forming components FUJI PHOTO FILM CO., LTD. (JP) 1988-07-20 EP disclosed