SCHEMBL6766331

SCHEMBL6766331

O=C1C2CN(Cc3ccccc3)CC2C(=O)N1c1cc(Cl)cc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.48
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
S1PR1 P21453 2/20 0.45
S1PR5 Q9H228 2/20 0.45
FUCA1 P04066 2/20 0.44
RORC P51449 1/20 0.44
SIGMAR1 Q99720 2/20 0.43
ITGB2 P05107 1/20 0.43
ICAM1 P05362 1/20 0.43
ITGAL P20701 1/20 0.43
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL1749014 0.88 SMN1; SMN2 (0.52) DRD2DRD3S1PR1S1PR5FUCA1
SCHEMBL9042636 0.88 SMN1; SMN2 (0.52) DRD2DRD3S1PR1S1PR5FUCA1
SCHEMBL6769537 0.87 KMT2A (0.49) SIGMAR1KMT2A
Hydrochloric Acid SCHEMBL1749238 0.86 SMN1; SMN2 (0.51) DRD2DRD3S1PR1S1PR5FUCA1
SCHEMBL27400032 0.81 POLB (0.51) S1PR1S1PR5RORCALDH1A1SMN1; SMN2
SCHEMBL23701396 0.78 KMT2A (0.55) DRD2DRD3SIGMAR1ALDH1A1MEN1
SCHEMBL584067 0.78 ALDH1A1 (0.67) S1PR1S1PR5FUCA1RORCALDH1A1
SCHEMBL6096881 0.78 ALDH1A1 (0.67) S1PR1S1PR5FUCA1RORCALDH1A1
SCHEMBL6775383 0.77 LMNA (0.41) DRD2SIGMAR1ALDH1A1MEN1MAPT
SCHEMBL1795199 0.76 FUCA1 (0.50) DRD2DRD3S1PR1S1PR5FUCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6710064-B2 FOR THERAPY OF INFLAMMATORY OR IMMUNE DISEASES BRISTOL-MYERS SQUIBB CO. 2004-03-23 US disclosed
US-20020143035-A1 Hydantoin compounds useful as anti-inflammatory agents BRISTOL-MYERS SQUIBB COMPANY 2002-10-03 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 (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-20020143035-A1 Hydantoin compounds useful as anti-inflammatory agents HRH4, IL4I1, HRH2 DPP4 769/4885DRD2 2250/4885DRD3 1725/4885

“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.