Phenol

Phenol

SCHEMBL7085974

C=O.C=O.Nc1nc(N)nc(N)n1.Oc1ccccc1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
GLA P06280 1/20 0.52
CA3 P07451 1/20 0.52
CA4 P22748 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
ADORA1 P30542 7/20 0.48
ADORA2A P29274 6/20 0.48
ADORA2B P29275 3/20 0.48
ADORA3 P0DMS8 2/20 0.48
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 2/20 0.44
RAB9A P51151 1/20 0.44
ALOX15 P16050 2/20 0.40
DCPS Q96C86 1/20 0.40
TSHR P16473 1/20 0.40

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 SCHEMBL112970 1.00 TDP1 (0.52) TDP1CA12CA1CA2GLA
Phenol SCHEMBL2269080 0.94 TDP1 (0.46) TDP1CA12CA1CA2GLA
Phenol SCHEMBL10783593 0.93 TDP1 (0.61) TDP1CA12CA1CA2GLA
Phenol SCHEMBL277221 0.93 TDP1 (0.61) TDP1CA12CA1CA2GLA
Phenol SCHEMBL5507454 0.90 SMN1; SMN2 (0.50) TDP1CA12CA1CA2GLA
Phenol SCHEMBL6392261 0.88 TDP1 (0.50) TDP1CA12CA1CA2GLA
Benzoguanamine SCHEMBL5501084 0.88 ADORA1 (0.70) ADORA1ADORA2AADORA2BADORA3POLB
Resorcinol SCHEMBL10407655 0.84 CA12 (0.55) TDP1CA12CA1CA2CA9
Phenol SCHEMBL3417346 0.82 CA2 (0.69) TDP1CA12CA1CA2GLA
Phenol SCHEMBL7783127 0.82 CA12 (0.79) TDP1CA12CA1CA2GLA

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
US-20030008586-A1 Low binder nonwoven fiber mats, laminates containing fibrous mat and methods of making JOHNS MANVILLE INTERNATIONAL, INC. 2003-01-09 US disclosed
US-4980410-A LOWER ACRYLATE, ACRYLONITRILE, AND GLYCIDYL ACRYLATE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-12-25 US disclosed