SCHEMBL29603876

SCHEMBL29603876

COCCn1c2nc(=O)n(-c3ccccc3)c(=O)c-2nc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NSD2 O96028 1/20 1.00
▸ IDO1 P14902 1/20 1.00
▸ CRHBP P24387 1/20 1.00
▸ TDO2 P48775 1/20 1.00
▸ CASP7 P55210 1/20 1.00
▸ CASP6 P55212 1/20 1.00
▸ CRHR2 Q13324 1/20 1.00
▸ HPGD P15428 1/20 0.57
▸ GSR P00390 6/20 0.57
▸ KDM4E B2RXH2 5/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ RECQL P46063 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ CASR P41180 1/20 0.48
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ GLA P06280 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ LMNA P02545 1/20 0.46

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
SCHEMBL5374411 0.73 HPGD (1.00) NSD2IDO1CRHBPTDO2CASP7
SCHEMBL5009001 0.72 HPGD (0.70) HPGDKDM4EALDH1A1SMN1; SMN2RECQL
SCHEMBL30497266 0.71 HPGD (0.62) NSD2IDO1CRHBPTDO2CASP7
SCHEMBL11306203 0.71 GSR (0.61) NSD2IDO1CRHBPTDO2CASP7
SCHEMBL3471027 0.70 TDP2 (0.62) NSD2IDO1CRHBPTDO2CASP7
SCHEMBL3979773 0.69 HPGD (0.62) NSD2IDO1CRHBPTDO2CASP7
SCHEMBL18997336 0.68 HPGD (0.65) NSD2IDO1CRHBPTDO2CASP7
SCHEMBL9318535 0.68 ALDH1A1 (0.60) NSD2IDO1CRHBPTDO2CASP7
Hydrochloric Acid SCHEMBL7183276 0.68 HPGD (0.68) NSD2IDO1CRHBPTDO2CASP7
Hydrochloric Acid SCHEMBL7171387 0.68 HPGD (0.68) NSD2IDO1CRHBPTDO2CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220251569-A1 TREATMENT AND PREVENTION OF DISEASE MEDIATED BY WWP2 NATIONAL UNIVERSITY OF SINGAPORE (SG) 2022-08-11 — — US disclosed
CN-114641571-A Treatment and prevention of WWP2 mediated diseases 新加坡国立大学 2022-06-17 — — CN disclosed
EP-3983544-A1 TREATMENT AND PREVENTION OF DISEASE MEDIATED BY WWP2 National University of Singapore (SG) 2022-04-20 — — EP disclosed
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