Propanol

Propanol

SCHEMBL524035

CC(O)COc1ccccc1C(=O)O.CCCO

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ ABCB1 P08183 9/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ PTK2B Q14289 1/20 0.50
▸ HTT P42858 2/20 0.49
▸ LMNA P02545 1/20 0.47
▸ HPGD P15428 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ AGER Q15109 1/20 0.46
▸ TSHR P16473 2/20 0.45
▸ ESR1 P03372 1/20 0.45
▸ ITGB3 P05106 1/20 0.45
▸ ITGA2B P08514 1/20 0.45
▸ HMGB1 P09429 1/20 0.45
▸ GGT1 P19440 1/20 0.45
▸ PTGS1 P23219 1/20 0.45
▸ PTGS2 P35354 1/20 0.45

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
SCHEMBL477006 0.81 ALDH1A1 (0.59) KDM4EKMT2AMEN1RECQLABCB1
SCHEMBL10821861 0.81 KDM4E (0.52) KDM4EKMT2AMEN1RECQLABCB1
SCHEMBL11629879 0.80 ABCB1 (0.53) ABCB1HTTLMNATSHR
SCHEMBL1552388 0.80 KDM4E (0.55) KDM4EKMT2AMEN1RECQLABCB1
Benzene SCHEMBL28043964 0.80 ALDH1A1 (0.57) KDM4EKMT2AMEN1RECQLABCB1
Bicarbonate SCHEMBL20694841 0.80 ALDH1A1 (0.57) KDM4EKMT2AMEN1RECQLABCB1
Bicarbonate SCHEMBL29943829 0.80 ALDH1A1 (0.57) KDM4EKMT2AMEN1RECQLABCB1
SCHEMBL17799583 0.80 ALDH1A1 (0.57) KDM4EKMT2AMEN1RECQLABCB1
Bicarbonate SCHEMBL236893 0.80 ALDH1A1 (0.57) KDM4EKMT2AMEN1RECQLABCB1
SCHEMBL9627874 0.79 ABCB1 (0.65) ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2598472-A2 FORMULATIONS Syngenta Limited (GB) 2013-06-05 — — EP claimed
WO-2012014152-A2 FORMULATIONS SYNGENTA LIMITED (GB) 2012-02-02 — — WO claimed
Send feedback