Phenol

Phenol

SCHEMBL28103148

Cc1c(C(C)(C)C)cccc1C(C)(C)C.Oc1ccccc1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.54
ALDH1A1 P00352 5/20 0.52
TDP1 Q9NUW8 2/20 0.52
TSHR P16473 1/20 0.52
GABRA1 P14867 1/20 0.52
GABRB2 P47870 1/20 0.52
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
GLA P06280 1/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
ESR1 P03372 3/20 0.43
ESR2 Q92731 3/20 0.43
CYP3A4 P08684 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TYR P14679 3/20 0.39
LMNA P02545 2/20 0.39
ALOX12 P18054 1/20 0.39

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 SCHEMBL28173829 0.90 GABRA1 (0.57) CA2ALDH1A1TDP1TSHRGABRA1
Phenol SCHEMBL28121463 0.86 ALDH1A1 (0.61) CA2ALDH1A1TDP1TSHRGABRA1
Phenol SCHEMBL7888105 0.84 CA2 (0.77) CA2ALDH1A1TDP1TSHRGABRA1
SCHEMBL5061063 0.83 CA2 (0.57) CA2ALDH1A1TDP1TSHRGABRA1
Phenol SCHEMBL27866900 0.83 GABRA1 (0.57) CA2ALDH1A1TDP1TSHRGABRA1
Phenol SCHEMBL11695829 0.82 ALDH1A1 (0.47) CA2ALDH1A1TDP1TSHRGABRA1
Phenol SCHEMBL8352828 0.82 GABRA1 (0.81) CA2ALDH1A1TDP1TSHRGABRA1
Phenol SCHEMBL28769599 0.80 GABRA1 (0.55) CA2ALDH1A1TDP1TSHRGABRA1
Phenol SCHEMBL6238567 0.80 ALDH1A1 (0.82) CA2ALDH1A1TDP1TSHRGABRA1
Phenol SCHEMBL27813668 0.79 CA2 (0.61) CA2ALDH1A1TDP1TSHRGABRA1

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
CN-105949872-B Water-borne UV-curing ink and preparation method thereof 上海墨传新材料科技有限公司 2019-02-15 CN disclosed
CN-106497387-B Photochromic nano silver metal grid transparent conductive film ultraviolet photocureable material 连云港华海诚科电子材料有限公司 2018-11-27 CN disclosed
CN-106497387-A Photochromic nano silver metal grid nesa coating ultraviolet photocureable material 连云港华海诚科电子材料有限公司 2017-03-15 CN disclosed
CN-105949872-A Water-based UV (ultraviolet) curing printing ink and method for preparing same 上海墨传新材料科技有限公司 2016-09-21 CN disclosed