SCHEMBL29409602

SCHEMBL29409602

CCOC(=O)c1cc(C#N)c(N2CCC(C(=O)NS(=O)(=O)Cc3ccccc3)CC2)nc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 19/20 1.00
CYP2C9 P11712 8/20 1.00
CYP3A4 P08684 6/20 1.00
CHRM2 P08172 1/20 1.00
DRD3 P35462 1/20 1.00
CYP2C19 P33261 1/20 0.72

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
SCHEMBL3216200 1.00 P2RY12 (1.00) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL29409601 1.00 P2RY12 (1.00) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL4996029 0.97 P2RY12 (0.94) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL4876836 0.94 P2RY12 (0.90) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL4871252 0.94 P2RY12 (0.89) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL4877635 0.94 P2RY12 (0.92) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL4872315 0.94 P2RY12 (0.91) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL4871555 0.94 P2RY12 (1.00) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL4878733 0.94 P2RY12 (0.88) P2RY12CYP2C9CYP3A4CHRM2DRD3
SCHEMBL4880786 0.93 P2RY12 (0.87) P2RY12CYP2C9CYP3A4CHRM2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025229484-A1 PURINERGIC P2 RECEPTOR ANTAGONISTS FOR USE IN THE TREATMENT OF CONGENITAL SIDEROBLASTIC ANEMIAS UNIVERSITÀ DEGLI STUDI DI BARI ALDO MORO (IT) 2025-11-06 WO claimed
US-20260091147-A1 METHOD FOR DETECTING INNATE IMMUNE ACTION IN VIVO USING GPR84-PET THE BOARD OF TRUSTEES OF THE LELAND STANDFORD JUNIOR UNIV (US) 2026-04-02 US disclosed
EP-4655302-A1 TYRO3 SELECTIVE INHIBITORS AND USES THEREOF The University of North Carolina at Chapel Hill (US) 2025-12-03 EP disclosed
WO-2025229484-A1 PURINERGIC P2 RECEPTOR ANTAGONISTS FOR USE IN THE TREATMENT OF CONGENITAL SIDEROBLASTIC ANEMIAS UNIVERSITÀ DEGLI STUDI DI BARI ALDO MORO (IT) 2025-11-06 WO disclosed
WO-2024220480-A2 METHOD FOR DETECTING INNATE IMMUNE ACTION IN VIVO USING GPR84-PET THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2024-10-24 WO disclosed
WO-2024159097-A1 TYRO3 SELECTIVE INHIBITORS AND USES THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2024-08-02 WO disclosed
EP-4399282-A2 COMPOSITIONS OF INDUCED PLURIPOTENT STEM CELL-DERIVED CELLS AND METHODS OF USE THEREOF Fujifilm Cellular Dynamics, Inc. (US) 2024-07-17 EP disclosed
CN-118234849-A Compositions for inducing pluripotent stem cell-derived cells and methods of use thereof 富士胶片细胞动力公司 2024-06-21 CN disclosed
US-20230183644-A1 COMPOSITIONS OF INDUCED PLURIPOTENT STEM CELL-DERIVED CELLS AND METHODS OF USE THEREOF FUJIFILM Cellular Dynamics, Inc. (US) 2023-06-15 US disclosed
WO-2023039567-A2 COMPOSITIONS OF INDUCED PLURIPOTENT STEM CELL-DERIVED CELLS AND METHODS OF USE THEREOF FUJIFILM Cellular Dynamics, Inc. (US) 2023-03-16 WO disclosed
US-20220251516-A1 METHODS FOR THE PRODUCTION OF MULTIPLE LINEAGES FROM INDUCED PLURIPOTENT STEM CELLS USING CHARGED SURFACES FUJIFILM Cellular Dynamics, Inc. (US) 2022-08-11 US disclosed
US-20220244263-A1 METHODS FOR TREATING SMALL CELL NEUROENDOCRINE AND RELATED CANCERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-08-04 US disclosed
EP-3983528-A1 METHODS FOR THE PRODUCTION OF MULTIPLE LINEAGES FROM INDUCED PLURIPOTENT STEM CELLS USING CHARGED SURFACES FUJIFILM Cellular Dynamics, Inc. (US) 2022-04-20 EP disclosed
CN-114174493-A Methods for generating multiple lineages from induced pluripotent stem cells using charged surfaces 富士胶片细胞动力公司 2022-03-11 CN 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-20260091147-A1 METHOD FOR DETECTING INNATE IMMUNE ACTION IN VIVO USING GPR84-PET GPR84, GPR65, GPR88 P2RY12 155/4885CYP2C9 3594/4885CYP3A4 2132/4885

“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.