Catechol

Catechol

SCHEMBL10571606

O=C(O)C1CCCCC1.O=C(O)C1CCCCC1.Oc1ccccc1O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.52
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
LMNA P02545 3/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.47
HTT P42858 1/20 0.47
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
AKR1C3 P42330 1/20 0.44
AKR1C1 Q04828 1/20 0.44
POLB P06746 2/20 0.44
ELANE P08246 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
CETP P11597 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 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
Biphenyl SCHEMBL8962449 0.85 RAB9A (0.61) HPGDNPC1RAB9ALMNAALDH1A1
Benzene SCHEMBL30877920 0.84 CES2 (0.55) HPGDNPC1RAB9ALMNAALDH1A1
Benzene SCHEMBL30877927 0.84 CES2 (0.55) HPGDNPC1RAB9ALMNAALDH1A1
Benzene SCHEMBL9226365 0.84 CES2 (0.55) HPGDNPC1RAB9ALMNAALDH1A1
Hydroquinone SCHEMBL10574407 0.83 MIF (0.49) HPGDNPC1RAB9AESR1POLB
Benzene SCHEMBL9232305 0.82 TSHR (0.50) HPGDNPC1RAB9ALMNAALDH1A1
Benzoic Acid SCHEMBL31356467 0.82 SRD5A2 (0.58) HPGDNPC1RAB9AALDH1A1HTT
Toluene SCHEMBL27671461 0.82 HPGD (0.50) HPGDNPC1RAB9ALMNAALDH1A1
Phthalic Acid SCHEMBL27732928 0.82 ALDH1A1 (0.56) HPGDNPC1RAB9ALMNAALDH1A1
O-Xylene SCHEMBL28135791 0.82 P2RX7 (0.54) HPGDNPC1RAB9ALMNAMEN1

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
US-4833023-A CONTAINING SOILD PLASTICIZER MITSUBISHI PAPER MILLS, LTD. (JP) 1989-05-23 US claimed
US-4745026-A FINE PARTICLE SOLID PLASTICIZER MITSUBISHI PAPER MILLS, LTD. (JP) 1988-05-17 US claimed
US-4833023-A CONTAINING SOILD PLASTICIZER MITSUBISHI PAPER MILLS, LTD. (JP) 1989-05-23 US disclosed
US-4745026-A FINE PARTICLE SOLID PLASTICIZER MITSUBISHI PAPER MILLS, LTD. (JP) 1988-05-17 US disclosed