SCHEMBL11030563

SCHEMBL11030563

O=Cc1ccc(C(=O)c2ccc(O)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH5A1 P51649 2/20 0.73
ABAT P80404 2/20 0.73
MAPT P10636 3/20 0.68
LMNA P02545 2/20 0.68
HTT P42858 2/20 0.68
ESR1 P03372 2/20 0.68
ESR2 Q92731 2/20 0.68
PKM P14618 1/20 0.68
HPGD P15428 1/20 0.68
ALDH1A1 P00352 3/20 0.58
SRD5A2 P31213 1/20 0.58
MAPK1 P28482 1/20 0.56
MEN1 O00255 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
F3 P13726 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.48
POLB P06746 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
4-Hydroxybenzaldehyde SCHEMBL28345913 0.92 KMT2A (0.66) ALDH5A1ABATMAPTLMNAHTT
SCHEMBL6852409 0.91 ALDH1A1 (0.68) ALDH5A1ABATMAPTLMNAHTT
4-Hydroxybenzaldehyde SCHEMBL37193 0.85
4-Hydroxybenzaldehyde SCHEMBL19328157 0.85 ALDH5A1 (1.00) ALDH5A1ABATMAPTLMNAESR1
4-Hydroxybenzaldehyde SCHEMBL28616388 0.83 ALDH5A1 (0.84) ALDH5A1ABATMAPTESR1ESR2
4-Hydroxybenzaldehyde SCHEMBL5161739 0.83 ALDH5A1 (0.94) ALDH5A1ABATMAPTLMNAESR1
4-Hydroxybenzaldehyde SCHEMBL29153364 0.83 ALDH5A1 (0.94) ALDH5A1ABATMAPTLMNAESR1
4-Hydroxybenzaldehyde SCHEMBL29952471 0.83 ALDH5A1 (0.94) ALDH5A1ABATMAPTLMNAESR1
4-Hydroxybenzaldehyde SCHEMBL2187647 0.83 ALDH5A1 (0.94) ALDH5A1ABATMAPTLMNAESR1
4-Hydroxybenzaldehyde SCHEMBL28981620 0.83 ALDH5A1 (0.94) ALDH5A1ABATMAPTLMNAESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0069587-B1 OPTICALLY ANISOTROPIC MELT FORMING POLYESTERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-05-22 EP disclosed
EP-0069587-A1 Optically anisotropic melt forming polyesters E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-12 EP disclosed
EP-0069587-A1 Optically anisotropic melt forming polyesters E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-12 EP disclosed
US-4335232-A AROMATIC POLYESTER-POLYLACTONE COPOLYMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-06-15 US disclosed
US-4335232-A AROMATIC POLYESTER-POLYLACTONE COPOLYMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-06-15 US disclosed