SCHEMBL6355545

SCHEMBL6355545

c1ccc(-c2ccc3cnccc3c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 7/20 0.61
CYP11B1 P15538 6/20 0.61
CYP19A1 P11511 4/20 0.61
CYP17A1 P05093 4/20 0.61
PRKCZ Q05513 1/20 0.59
TDO2 P48775 2/20 0.54
ESR1 P03372 1/20 0.52
ESR2 Q92731 1/20 0.52
AKT1 P31749 2/20 0.51
MAPK10 P53779 1/20 0.50
CDC7 O00311 1/20 0.49
CCNE1 P24864 1/20 0.49
CDK2 P24941 1/20 0.49
DBF4 Q9UBU7 1/20 0.49
IMPDH2 P12268 2/20 0.49
HASPIN Q8TF76 1/20 0.49
NOTUM Q6P988 1/20 0.48

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
SCHEMBL5007325 0.92 PRKCZ (0.70) CYP11B2CYP11B1CYP19A1CYP17A1PRKCZ
SCHEMBL18891280 0.90 CYP11B1 (0.69) CYP11B2CYP11B1CYP19A1CYP17A1PRKCZ
SCHEMBL444504 0.88 PRKCZ (0.63) CYP11B2CYP11B1CYP19A1CYP17A1PRKCZ
SCHEMBL22215497 0.87 CYP11B2 (0.56) CYP11B2CYP11B1CYP19A1CYP17A1PRKCZ
SCHEMBL18556708 0.86 CYP11B1 (0.69) CYP11B2CYP11B1CYP19A1CYP17A1PRKCZ
SCHEMBL26565936 0.85 NOTUM (0.68) CYP11B2CYP11B1CYP19A1CYP17A1ESR1
SCHEMBL27895115 0.84 CYP11B2 (0.85) CYP11B2CYP11B1CYP19A1CYP17A1
SCHEMBL26565897 0.84 CYP11B2 (0.85) CYP11B2CYP11B1CYP19A1CYP17A1
SCHEMBL22215534 0.84 PRKCZ (0.56) CYP11B2CYP11B1CYP19A1CYP17A1PRKCZ
SCHEMBL17229031 0.83 TDO2 (0.57) CYP11B2CYP11B1CYP19A1CYP17A1PRKCZ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107074958-A Anti- PD L1 for treating tumour are combined 博笛生物科技有限公司 2017-08-18 CN disclosed
CN-107074959-A Anti- PD L1 conjugates for treating tumour 博笛生物科技有限公司 2017-08-18 CN disclosed
CN-106943596-A anti-CD 20 combination for use in the treatment of tumors 博笛生物科技(北京)有限公司 2017-07-14 CN disclosed
CN-106943598-A anti-HER 2 combination for treating tumors 博笛生物科技(北京)有限公司 2017-07-14 CN disclosed
CN-106535938-A Combination therapeutic compositions and combination therapeutic methods for treating cancer 上海博笛生物科技有限公司 2017-03-22 CN disclosed
US-6933306-B2 Hydroxamic and carboxylic acid derivatives DARWIN DISCOVERY LTD. (GB) 2005-08-23 US disclosed
US-20030092727-A1 Hydroxamic and carboxylic acid derivatives HANNAH DUNCAN ROBERT (GB) 2003-05-15 US disclosed
EP-1292576-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES HAVING MMP AND TNF INHIBITORY ACTIVITY Darwin Discovery Limited (GB) 2003-03-19 EP disclosed
US-6506773-B2 For therapy of cancer; inflammation; an autoimmune, infectious or ocular disease; or age-related macular degeneration DARWIN DISCOVERY LTD. (GB) 2003-01-14 US disclosed
US-20020022635-A1 Hydroxamic and carboxylic acid derivatives DARWIN DISCOVERY LIMITED (GB) 2002-02-21 US disclosed
WO-2001087844-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES HAVING MMP AND TNF INHIBITORY ACTIVITY DARWIN DISCOVERY LIMITED (GB) 2001-11-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030092727-A1 Hydroxamic and carboxylic acid derivatives UACA, HCAR2, HCAR1 CYP11B2 1816/4885CYP11B1 1849/4885CYP19A1 2074/4885
US-20020022635-A1 Hydroxamic and carboxylic acid derivatives HCAR1, HCAR2, HCAR3 CYP11B2 383/4885CYP11B1 521/4885CYP19A1 2619/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.