SCHEMBL381684

SCHEMBL381684

CCn1cnc2c1c(=O)[nH]c(=O)n2C

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 5/20 0.71
ADORA2A P29274 5/20 0.71
PDE4B Q07343 5/20 0.71
PDE4C Q08493 5/20 0.71
PDE4D Q08499 5/20 0.71
BRD4 O60885 5/20 0.68
BRD2 P25440 2/20 0.68
BRD3 Q15059 2/20 0.68
BRDT Q58F21 2/20 0.68
MAPK1 P28482 2/20 0.66
CYP3A4 P08684 1/20 0.66
PMP22 Q01453 1/20 0.66
SMN1; SMN2 Q16637 2/20 0.63
LMNA P02545 2/20 0.61
KDM4E B2RXH2 1/20 0.61
POLB P06746 1/20 0.61
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 2/20 0.57
ADORA2B P29275 1/20 0.49

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
SCHEMBL1495090 0.89 PDE4A (0.76) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL4566277 0.86 MEN1 (0.77) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL16675435 0.86 MAPK1 (0.64) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL10955005 0.86 MAPK1 (0.64) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL25286006 0.85 ALDH1A1 (0.71) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL17682204 0.85 MAPK1 (0.59) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL17682216 0.84 SMN1; SMN2 (0.64) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL516463 0.84 PDE4A (0.81) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL7464093 0.84 MAPK1 (0.57) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL11400162 0.84 MEN1 (0.69) PDE4AADORA2APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4748455-A1 ANTI-GREY-HAIR COMPOSITION COMPRISING PLANT EXTRACTS Wella Germany GmbH (DE) 2026-05-27 EP disclosed
EP-4748454-A1 ANTI-GREY-HAIR COMPOSITION Wella Germany GmbH (DE) 2026-05-27 EP disclosed
US-20260137750-A1 ANTI-GREY-HAIR COMPOSITION WELLA GERMANY GMBH (DE) 2026-05-21 US disclosed
US-20250179130-A1 METHODS AND SYSTEMS FOR DESIGNING AND/OR CHARACTERIZING SOLUBLE LIPIDATED LIGAND AGENTS ON TARGET THERAPEUTICS LLC 2025-06-05 US disclosed
EP-4545063-A1 COSMETICAL USE OF A TOPICALLY APPLICABLE RINSE-OF COMPOSITION (RC) Wella Germany GmbH (DE) 2025-04-30 EP disclosed
CN-119868176-A Cosmetic use of a topically applicable rinse-off composition (RC) 威娜德国有限责任公司 2025-04-25 CN disclosed
US-20250127701-A1 Cosmetical use of a topically applicable rinse-of composition (RC) WELLA GERMANY GMBH (DE) 2025-04-24 US disclosed
EP-4531801-A1 IMPROVING HAIR STRUCTURE Wella Germany GmbH (DE) 2025-04-09 EP disclosed
EP-4262738-B1 METHOD FOR OBTAINING AQUEOUS EXTRACTS OF TEA LEAVES, COMPOSITIONS COMPRISING SUCH EXTRACTS AND COSMETIC USES THEREOF ISP INVESTMENTS LLC (US) 2025-02-19 EP disclosed
US-20240374503-A1 BLACK TEA LEAF EXTRACT, COMPOSITIONS CONTAINING SAME, AND COSMETIC USES THEREOF ISP INVESTMENTS LLC 2024-11-14 US disclosed
US-20020034485-A1 Hair tonic for prevention or treatment of hair loss WELLA AKTIENGESELLSCHAFT (DE) 2002-03-21 US disclosed
EP-1179334-A2 Hair tonic for preventing or treating hair loss Wella Aktiengesellschaft (DE) 2002-02-13 EP disclosed
EP-0771813-B1 Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines HOECHST AG (DE) 2002-01-16 EP disclosed
CN-1058855-C Sweet tea and its prepn SHI YULIN (CN) 2000-11-29 CN disclosed
US-5728686-A TREATMENT OF MUSCULAR DYSTROPHY HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-17 US disclosed
CN-1158855-A Alkylxanthine phosphonates and alkylxanthine phosphine oxides and their use as pharmacueticals HOECHST AG (DE) 1997-09-10 CN disclosed
EP-0771813-A1 Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-07 EP disclosed
US-4904773-A FORMING COMPLEXES WITH CYCLODEXTRIN ALLELIX INC. (CA) 1990-02-27 US disclosed
US-4289776-A VASODILATORS, FIBRINOLYTIC HOECHST AKTIENGESELLSCHAFT (DE) 1981-09-15 US disclosed
US-4108995-A CEREBRAL BLOOD FLOW HOECHST AKTIENGESELLSCHAFT (DE) 1978-08-22 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 (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-20260137750-A1 ANTI-GREY-HAIR COMPOSITION OAT, CUTA, NASP PDE4A 4009/4885ADORA2A 1900/4885PDE4B 3965/4885
US-20250179130-A1 METHODS AND SYSTEMS FOR DESIGNING AND/OR CHARACTERIZING SOLUBLE LIPIDATED LIGAND AGENTS LDLR, HDLBP, LIPG PDE4A 3357/4885ADORA2A 1114/4885PDE4B 3408/4885

“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.