SCHEMBL680856

SCHEMBL680856

c1ccc(-c2ncc3[nH]cnc3n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 1/20 0.55
ADORA3 P0DMS8 7/20 0.54
ADORA2A P29274 6/20 0.54
ADORA1 P30542 5/20 0.54
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MAPK14 Q16539 1/20 0.46
HPGDS O60760 2/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 1/20 0.41

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 SCHEMBL4456682 0.98 CDK2 (0.54) CDK2ADORA3ADORA2AADORA1ALDH1A1
SCHEMBL6385068 0.83 QPCT (0.50) CDK2ADORA3ADORA2AALDH1A1KDM4E
SCHEMBL29452971 0.82 ALDH1A1 (0.63) CDK2ADORA3ADORA2AADORA1ALDH1A1
SCHEMBL4924100 0.78 KDM4E (0.48) CDK2ALDH1A1KDM4ENPC1RAB9A
SCHEMBL4875493 0.78 ALDH1A1 (0.53) CDK2ADORA3ADORA2AADORA1ALDH1A1
SCHEMBL14826053 0.78 ALDH1A1 (0.42) CDK2ADORA3ADORA2AADORA1ALDH1A1
SCHEMBL27695978 0.77 CDK2 (0.47) CDK2ALDH1A1KDM4ENPC1RAB9A
SCHEMBL27469940 0.75 CDK2 (0.51) CDK2ADORA3ADORA2AADORA1ALDH1A1
SCHEMBL5425282 0.75 ADORA2A (0.49) CDK2ADORA3ADORA2AADORA1ALDH1A1
SCHEMBL369487 0.74 NPC1 (0.51) CDK2ADORA3ADORA2AADORA1ALDH1A1

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 142 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4363043-B1 COMPOSITIONS FOR USE IN METHODS FOR INCREASING CANCER CELL SENSITIVITY TO ALTERNATING ELECTRIC FIELDS NOVOCURE GMBH (CH) 2026-04-22 EP claimed
US-12594421-B2 Compositions and methods for increasing cancer cell sensitivity to alternating electric fields NOVOCURE GMBH (CH) 2026-04-07 US claimed
US-20250339680-A1 COMPOSITIONS AND METHODS FOR INCREASING CANCER CELL SENSITIVITY TO ALTERNATING ELECTRIC FIELDS NOVOCURE GMBH (CH) 2025-11-06 US claimed
CN-118930544-A 8-Nitrogen mustard phenyl-7H-purine derivative with antitumor activity and preparation method and application thereof 广东海洋大学 2024-11-12 CN claimed
EP-4363043-A1 COMPOSITIONS AND METHODS FOR INCREASING CANCER CELL SENSITIVITY TO ALTERNATING ELECTRIC FIELDS Novocure GmbH (CH) 2024-05-08 EP claimed
CN-117580614-A Compositions and methods for increasing sensitivity of cancer cells to alternating electric fields 诺沃库勒有限责任公司 2024-02-20 CN claimed
CN-116390760-A Compositions and methods for increasing sensitivity of cancer cells to alternating electric fields 诺沃库勒有限责任公司 2023-07-04 CN claimed
EP-4188380-A1 COMPOSITIONS AND METHODS FOR INCREASING CANCER CELL SENSITIVITY TO ALTERNATING ELECTRIC FIELDS Novocure GmbH (CH) 2023-06-07 EP claimed
WO-2023275649-A1 COMPOSITIONS AND METHODS FOR INCREASING CANCER CELL SENSITIVITY TO ALTERNATING ELECTRIC FIELDS NOVOCURE GMBH (CH) 2023-01-05 WO claimed
US-20230001193-A1 COMPOSITIONS AND METHODS FOR INCREASING CANCER CELL SENSITIVITY TO ALTERNATING ELECTRIC FIELDS BIOPHARMA CREDIT PLC (GB) 2023-01-05 US claimed
US-20220096818-A1 Compositions And Methods For Increasing Cancer Cell Sensitivity To Alternating Electric Fields BIOPHARMA CREDIT PLC (GB) 2022-03-31 US claimed
WO-2022029628-A1 COMPOSITIONS AND METHODS FOR INCREASING CANCER CELL SENSITIVITY TO ALTERNATING ELECTRIC FIELDS NOVOCURE GMBH (CH) 2022-02-10 WO claimed
US-20140011809-A1 DRUG DELIVERY TO THE ANTERIOR AND POSTERIOR SEGMENTS OF THE EYE USING EYE DROPS REKIK RAOUF (TN) 2014-01-09 US claimed
US-20060172922-A1 Methods for combating ischemic injury to epithelial organ THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-08-03 US claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed
US-4169717-A METAL PROTEINATE AND GROWTH HORMONE ASHMEAD H H 1979-10-02 US claimed
EP-4363043-B1 COMPOSITIONS FOR USE IN METHODS FOR INCREASING CANCER CELL SENSITIVITY TO ALTERNATING ELECTRIC FIELDS NOVOCURE GMBH (CH) 2026-04-22 EP disclosed
US-12594421-B2 Compositions and methods for increasing cancer cell sensitivity to alternating electric fields NOVOCURE GMBH (CH) 2026-04-07 US disclosed
EP-0079123-A1 Benzoquinolizines JOHN WYETH & BROTHER LIMITED (GB) 1983-05-18 EP disclosed
US-4186184-A Selective administration of drug with ocular therapeutic system ALZA CORPORATION (US) 1980-01-29 US 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 (1 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-12594421-B2 Compositions and methods for increasing cancer cell sensitivity to alternating electric fields PTK2, GSK3B, MTOR CDK2 24/4885ADORA3 2414/4885ADORA2A 2346/4885

“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.