SCHEMBL3897124

SCHEMBL3897124

[c]1nncc2cnccc12

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPKAPK2 P49137 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31

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
SCHEMBL3897125 0.83 CLK1 (0.32)
SCHEMBL2957 0.73 CYP2A6 (0.32) LMNACYP1A2CYP3A4CYP2D6KDM4E
SCHEMBL28068731 0.71 KDM4E (0.31) LMNACYP1A2CYP3A4CYP2D6KDM4E
Hydrochloric Acid SCHEMBL28618702 0.71 KDM4E (0.33) LMNACYP1A2CYP3A4CYP2D6KDM4E
SCHEMBL159538 0.71 PRKCZ (0.33) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL27674458 0.70 PRKCZ (0.32) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL275946 0.68 LMNA (0.33) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL89121 0.66 CYP19A1 (0.39) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL30571321 0.66 CYP19A1 (0.39) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL29559681 0.66 CYP19A1 (0.39) LMNACYP1A2CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230102554-A1 HETEROCYCLIC KINASE INHIBITORS AND PRODUCTS AND USES THEREOF GB002, INC. 2023-03-30 US claimed
EP-3990443-A1 HETEROCYCLIC KINASE INHIBITORS AND PRODUCTS AND USES THEREOF GB002, Inc. (US) 2022-05-04 EP claimed
US-20210196717-A1 TOLL-LIKE RECEPTOR 4 (TLR4) INHIBITORS AND USE THEREOF BAR-ILAN UNIVERSITY (IL) 2021-07-01 US claimed
EP-3797100-A1 TOLL-LIKE RECEPTOR 4 (TLR4) INHIBITORS AND USE THEREOF Mor Research Applications Ltd. (IL) 2021-03-31 EP claimed
WO-2020264420-A1 HETEROCYCLIC KINASE INHIBITORS AND PRODUCTS AND USES THEREOF GB002, INC. (US) 2020-12-30 WO claimed
US-11925643-B2 Toll-like receptor 4 (TLR4) inhibitors and use thereof MOR RESEARCH APPLICATIONS LTD. (IL) 2024-03-12 US disclosed
US-20230102554-A1 HETEROCYCLIC KINASE INHIBITORS AND PRODUCTS AND USES THEREOF GB002, INC. 2023-03-30 US disclosed
WO-2022128850-A1 NOVEL ISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2022-06-23 WO disclosed
EP-3990443-A1 HETEROCYCLIC KINASE INHIBITORS AND PRODUCTS AND USES THEREOF GB002, Inc. (US) 2022-05-04 EP disclosed
US-20210196717-A1 TOLL-LIKE RECEPTOR 4 (TLR4) INHIBITORS AND USE THEREOF BAR-ILAN UNIVERSITY (IL) 2021-07-01 US disclosed
EP-3797100-A1 TOLL-LIKE RECEPTOR 4 (TLR4) INHIBITORS AND USE THEREOF Mor Research Applications Ltd. (IL) 2021-03-31 EP disclosed
WO-2020264420-A1 HETEROCYCLIC KINASE INHIBITORS AND PRODUCTS AND USES THEREOF GB002, INC. (US) 2020-12-30 WO disclosed
US-6992069-B2 Tricyclic macrolide antibacterial compounds ABBVIE INC. 2006-01-31 US disclosed
US-6933283-B2 11-deoxy azalide antibacterials ABBOTT LABORATORIES (US) 2005-08-23 US disclosed
US-20040029818-A1 Tricyclic macrolide antibacterial compounds ABBVIE INC. 2004-02-12 US disclosed
US-20040014687-A1 Macrolide antibacterial compounds ABBOTT LABORATORIES 2004-01-22 US disclosed
US-20040014688-A1 Oxolide antibacterials ABBVIE INC. 2004-01-22 US disclosed
US-20040014691-A1 9-Oxime macrolide antibacterials ABBOTT LABORATORIES 2004-01-22 US disclosed
US-20040014953-A1 11-Deoxy azalide antibacterials ABBVIE INC. 2004-01-22 US disclosed
US-20040009932-A1 Antibacterial compounds with activity against penicillin-resistant streptococcus pneumoniae ABBOTT LABORATORIES 2004-01-15 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 (9 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-20040014691-A1 9-Oxime macrolide antibacterials CYP2C9, CYP1B1, SULT1E1 LMNA 2161/4885CYP1A2 65/4885CYP3A4 71/4885
US-11925643-B2 Toll-like receptor 4 (TLR4) inhibitors and use thereof TLR4, TLR1, TLR3 LMNA 3069/4885CYP1A2 4840/4885CYP3A4 3759/4885
US-20040014687-A1 Macrolide antibacterial compounds MRPL21, NOP2, PIGS LMNA 1003/4885CYP1A2 127/4885CYP3A4 246/4885
US-20040029818-A1 Tricyclic macrolide antibacterial compounds RPN1, CASP1, MRPL21 LMNA 1662/4885CYP1A2 179/4885CYP3A4 90/4885
US-20040009932-A1 Antibacterial compounds with activity against penicillin-resistant streptococcus pneumoniae PGLS, GGPS1, CASP1 LMNA 1573/4885CYP1A2 262/4885CYP3A4 399/4885
US-20040014953-A1 11-Deoxy azalide antibacterials TOP1, TOP2B, TOP2A LMNA 2681/4885CYP1A2 166/4885CYP3A4 264/4885
US-20210196717-A1 TOLL-LIKE RECEPTOR 4 (TLR4) INHIBITORS AND USE THEREOF TLR4, TLR1, TLR3 LMNA 3069/4885CYP1A2 4840/4885CYP3A4 3759/4885
US-20230102554-A1 HETEROCYCLIC KINASE INHIBITORS AND PRODUCTS AND USES THEREOF PDGFRB, PDGFRA, FGFR1 LMNA 2517/4885CYP1A2 3184/4885CYP3A4 2040/4885
US-20040014688-A1 Oxolide antibacterials OGFOD1, PGLS, OXER1 LMNA 2757/4885CYP1A2 236/4885CYP3A4 353/4885

“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.