SCHEMBL31663772

SCHEMBL31663772

CC(C)(C)OC(=O)N1CCCC[C@H]1COc1ccc(NC(=O)C2CC2)cc1Br

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR3 P25089 1/20 0.49
FPR2 P25090 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 1/20 0.48
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
ABL1 P00519 1/20 0.44
RIN1 Q13671 1/20 0.44
LMNA P02545 3/20 0.42
HTT P42858 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MALT1 Q9UDY8 2/20 0.41
NPSR1 Q6W5P4 2/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39

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
SCHEMBL31663815 1.00 FPR3 (0.49) FPR3FPR2NPC1RAB9APTPN2
SCHEMBL31663780 0.93 NPC1 (0.48) FPR3FPR2NPC1RAB9APTPN2
SCHEMBL31663788 0.84 NPC1 (0.44) FPR3FPR2NPC1RAB9APTPN2
SCHEMBL31663763 0.84 NPC1 (0.44) FPR3FPR2NPC1RAB9APTPN2
SCHEMBL31663765 0.84 NPC1 (0.44) FPR3FPR2NPC1RAB9APTPN2
SCHEMBL29619163 0.84 ALOX5AP (0.45) FPR3FPR2NPC1RAB9AHTT
SCHEMBL31663762 0.84 ALOX5AP (0.45) FPR3FPR2NPC1RAB9AHTT
SCHEMBL29619008 0.84 ALOX5AP (0.45) FPR3FPR2NPC1RAB9AHTT
SCHEMBL31663794 0.83 NPC1 (0.43) FPR3FPR2NPC1RAB9APTPN2
SCHEMBL31663775 0.83 NPC1 (0.43) FPR3FPR2NPC1RAB9APTPN2

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 FPR3 1196/4885FPR2 644/4885NPC1 2828/4885
US-12559462-B2 Pyrimidine derivatives as modulators of the 5-HT2A serotonin receptor useful for the treatment of disorders related thereto HTR2C, HTR1A, HTR2A FPR3 405/4885FPR2 293/4885NPC1 612/4885

“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.