SCHEMBL31663787

SCHEMBL31663787

Cc1ncnc(C)c1-c1cc(NC(=O)C2CC2)ccc1O[C@@H]1CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.53
PIK3CA P42336 2/20 0.53
PIK3CB P42338 2/20 0.53
PIK3CG P48736 2/20 0.53
PTPN2 P17706 1/20 0.51
PTPN1 P18031 1/20 0.51
PTPN6 P29350 1/20 0.51
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
BRAF P15056 1/20 0.44
ABL1 P00519 1/20 0.44
RIN1 Q13671 1/20 0.44

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
SCHEMBL31663828 0.86 PIK3CD (0.45) PIK3CDPIK3CAPIK3CBPIK3CGPTPN2
SCHEMBL29619071 0.83 NPC1 (0.45) PIK3CDPIK3CAPIK3CBPIK3CGPTPN2
SCHEMBL31663766 0.83 PIK3CD (0.43) PIK3CDPIK3CAPIK3CBPIK3CGBRAF
SCHEMBL29619003 0.82 PTPN2 (0.45) PIK3CDPIK3CAPIK3CBPIK3CGPTPN2
SCHEMBL31663791 0.82 PTPN2 (0.55) PIK3CDPIK3CAPIK3CBPIK3CGPTPN2
SCHEMBL31663781 0.80 PIK3CD (0.47) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL31677893 0.80 POLB (0.48) NPC1RAB9AABL1
SCHEMBL31663776 0.79 PTPN2 (0.44) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL31663807 0.78 NPC1 (0.44) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL31663805 0.77 BCL9 (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559462-B2 Pyrimidine derivatives as modulators of the 5-HT2A serotonin receptor useful for the treatment of disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2026-02-24 US disclosed
US-20250270172-A1 Pyrimidine Derivatives As Modulators of the 5-HT2A Serotonin Receptor Useful For The Treatment of Disorders Related Thereto ARENA PHARMACEUTICALS, INC. (US) 2025-08-28 US disclosed
EP-4236937-B1 PYRIMIDINE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2025-07-23 EP 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-20250270172-A1 Pyrimidine Derivatives As Modulators of the 5-HT2A Serotonin Receptor Useful For The Treatment of Disorders Related Thereto HTR2A, HTR5A, HTR1A PIK3CD 1664/4885PIK3CA 1186/4885PIK3CB 1116/4885
US-12559462-B2 Pyrimidine derivatives as modulators of the 5-HT2A serotonin receptor useful for the treatment of disorders related thereto HTR2C, HTR1A, HTR2A PIK3CD 3082/4885PIK3CA 3460/4885PIK3CB 2518/4885

“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.