Phenol

Phenol

SCHEMBL1847412

CCN[C@@H](CC(N)=O)C(N)=O.Oc1ccccc1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ACE P12821 1/20 0.39
HPGDS O60760 5/20 0.39
ITGB2 P05107 1/20 0.38
ICAM1 P05362 1/20 0.38
ITGAL P20701 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MAPT P10636 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
Phenol SCHEMBL2640784 1.00 ALDH1A1 (0.40) ALDH1A1RAB9AMEN1KMT2AACE
Phenol SCHEMBL28162156 1.00 ALDH1A1 (0.40) ALDH1A1RAB9AMEN1KMT2AACE
Phenol SCHEMBL27348628 0.91 ALDH1A1 (0.46) ALDH1A1RAB9AMEN1KMT2AITGB2
Phenol SCHEMBL28342610 0.91 ALDH1A1 (0.46) ALDH1A1RAB9AMEN1KMT2AITGB2
Benzene SCHEMBL28092853 0.88 ECE1 (0.39) ALDH1A1RAB9AMEN1KMT2AITGB2
Phenol SCHEMBL170523 0.83 ALDH1A1 (0.39) ALDH1A1RAB9AMEN1KMT2AHPGDS
Phenol SCHEMBL29254468 0.83 ALDH1A1 (0.39) ALDH1A1RAB9AMEN1KMT2AHPGDS
SCHEMBL3856802 0.83 ECE1 (0.42) ITGB2ICAM1ITGAL
SCHEMBL7034111 0.83 ECE1 (0.42) ITGB2ICAM1ITGAL
SCHEMBL29181774 0.76 KDM4E (0.43) ALDH1A1RAB9AMEN1KMT2AKDM4E

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110506129-A Kit for identifying malignant tumor and application thereof AGENCY SCIENCE TECH & RES 2019-11-26 CN disclosed
CN-105263927-B Inhibitors of glutaminyl cyclase 前体生物药物股份公司 2019-03-15 CN disclosed
CN-108218849-A New inhibitor 前体生物药物股份公司 2018-06-29 CN disclosed
CN-106061974-B Maleimide derivatives as the conditioning agent of WNT approach 新加坡科技研究局 2018-04-20 CN disclosed
CN-106061974-A Maleimide derivatives as modulators of WNT pathway 新加坡科技研究局 2016-10-26 CN disclosed
CN-102186475-B novel inhibitors 前体生物药物股份公司 2016-08-03 CN disclosed
CN-105263927-A Novel inhibitors PROBILDRUG AG 2016-01-20 CN disclosed
CN-105246889-A Fluorinated integrin antagonists SCIFLUOR LIFE SCIENCES LLC 2016-01-13 CN disclosed
CN-102791704-B The heterocycle inhibitor of glutaminyl cyclase (QC, EC 2.3.2.5) PROBIODRUG AG (DE) 2015-11-25 CN disclosed
CN-104853758-A Treatment of pulmonary disease INTERCEPT PHARMACEUTICALS INC 2015-08-19 CN disclosed
EP-1040111-A1 INTEGRIN RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 2000-10-04 EP disclosed
WO-2000006169-A1 INTEGRIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2000-02-10 WO disclosed
WO-1999030713-A1 INTEGRIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1999-06-24 WO disclosed
WO-1999031099-A1 INTEGRIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1999-06-24 WO disclosed
EP-0885205-A1 FIBRINOGEN RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 1998-12-23 EP disclosed
CN-1202893-A Novel isoxazoline and isoxazole fibrinogen receptor antagonists DU PONT MERCK PHARMA (US) 1998-12-23 CN disclosed
WO-1997031910-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1997-09-04 WO disclosed
EP-0673247-A4 FIBRINOGEN RECEPTOR ANTAGONISTS. MERCK & CO INC (US) 1996-05-01 EP disclosed
EP-0673247-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1995-09-27 EP disclosed
WO-1994012181-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1994-06-09 WO disclosed