SCHEMBL29613822

SCHEMBL29613822

Oc1ccc2ccccc2c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 1.00
POLB P06746 1/20 0.60
CYP1A2 P05177 2/20 0.58
HSD17B10 Q99714 2/20 0.58
USP2 O75604 1/20 0.58
PAK1 Q13153 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
ALDH1A1 P00352 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
CYP2A6 P11509 1/20 0.55
TSHR P16473 1/20 0.55
GAA P10253 2/20 0.54
MAPT P10636 2/20 0.54
LDHA P00338 1/20 0.54
KDM4E B2RXH2 1/20 0.54
TAAR1 Q96RJ0 1/20 0.54
ERN1 O75460 1/20 0.54
IDO1 P14902 1/20 0.52
HPRT1 P00492 1/20 0.50

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
Hydrochloric Acid SCHEMBL28347175 1.00 PTPN22 (1.00) PTPN22POLBCYP1A2HSD17B10USP2
SCHEMBL28483 1.00 PTPN22 (1.00) PTPN22POLBCYP1A2HSD17B10USP2
Hydrochloric Acid SCHEMBL27843667 1.00 PTPN22 (1.00) PTPN22POLBCYP1A2HSD17B10USP2
SCHEMBL30871542 0.97 PTPN22 (0.95) PTPN22POLBCYP1A2HSD17B10USP2
Naphthalene SCHEMBL4847677 0.97 PTPN22 (0.95) PTPN22POLBCYP1A2HSD17B10USP2
SCHEMBL30661812 0.97 PTPN22 (0.95) PTPN22POLBCYP1A2HSD17B10USP2
Water SCHEMBL10892200 0.97 PTPN22 (0.95) PTPN22POLBCYP1A2HSD17B10USP2
SCHEMBL4068022 0.97 PTPN22 (0.95) PTPN22POLBCYP1A2HSD17B10USP2
Charcoal, Activated SCHEMBL2574660 0.97 PTPN22 (0.95) PTPN22POLBCYP1A2HSD17B10USP2
Methane SCHEMBL27863330 0.97 PTPN22 (0.95) PTPN22POLBCYP1A2HSD17B10USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022140532-A2 TOXIN AND GAS ADSORPTION BY POROUS MELANIN NORTHWESTERN UNIVERSITY (US) 2022-06-30 WO claimed
EP-3990423-A2 ARTIFICIAL MELANIN NANOPARTICLES AND METHODS INCLUDING POROUS MELANIN MATERIALS Northwestern University (US) 2022-05-04 EP claimed
EP-4604929-A2 HYDROPHOBIC SYNTHETIC MELANIN NANOPARTICLES Northwestern University (US) 2025-08-27 EP disclosed
WO-2024107309-A9 HYDROPHOBIC SYNTHETIC MELANIN NANOPARTICLES NORTHWESTERN UNIVERSITY (US) 2024-08-02 WO disclosed
WO-2024107309-A2 HYDROPHOBIC SYNTHETIC MELANIN NANOPARTICLES NORTHWESTERN UNIVERSITY (US) 2024-05-23 WO disclosed
EP-4330220-A1 MELANIN MATERIALS FOR TISSUE REPAIR Northwestern University (US) 2024-03-06 EP disclosed
CN-110799483-B Active ester compound and curable composition DIC株式会社 2023-04-14 CN disclosed
WO-2022232356-A1 MELANIN MATERIALS FOR TISSUE REPAIR NORTHWESTERN UNIVERSITY (US) 2022-11-03 WO disclosed
WO-2022140532-A2 TOXIN AND GAS ADSORPTION BY POROUS MELANIN NORTHWESTERN UNIVERSITY (US) 2022-06-30 WO disclosed
EP-3990423-A2 ARTIFICIAL MELANIN NANOPARTICLES AND METHODS INCLUDING POROUS MELANIN MATERIALS Northwestern University (US) 2022-05-04 EP disclosed