SCHEMBL1873749

SCHEMBL1873749

Cc1cccc(C(N)=O)c1C1NCC(O)C1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 1/20 0.43
▸ FUCA1 P04066 9/20 0.40
▸ GLB1 P16278 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ PARP1 P09874 4/20 0.35

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
SCHEMBL1873751 0.81 GBA1 (0.43) GBA1FUCA1GLB1PARP1
SCHEMBL1861356 0.77 GBA1 (0.43) GBA1FUCA1GLB1
SCHEMBL2346601 0.74 GBA1 (0.41) GBA1FUCA1GLB1ALDH1A1HPGD
SCHEMBL2353762 0.74 GBA1 (0.38) GBA1FUCA1GLB1
SCHEMBL2352472 0.74 PARP1 (0.33) ALDH1A1HPGDPARP1
SCHEMBL3809365 0.72 PARP1 (0.51) PARP1
SCHEMBL3840452 0.72 CXCR5 (0.45) KDM4EALDH1A1HPGDHSD17B10PARP1
SCHEMBL4359667 0.70 CXCR5 (0.52) KDM4EALDH1A1HPGDHSD17B10PARP1
SCHEMBL4781388 0.69 PARP1 (0.54) PARP1
SCHEMBL4141784 0.69 CXCR5 (0.51) KDM4EALDH1A1HPGDHSD17B10PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110237538-A1 TREATMENT OF LYSOSOMAL STORAGE DISORDERS AND OTHER PROTEOSTATIC DISEASES SUMMIT CORPORATION PLC (GB) 2011-09-29 — — US disclosed
US-20110195929-A1 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS SUMMIT CORPORATION PLC (GB) 2011-08-11 — — US disclosed
EP-2323651-A2 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS Summit Corporation Plc (GB) 2011-05-25 — — EP disclosed
WO-2010049678-A2 TREATMENT OF ENERGY UTILIZATION DISEASES SUMMIT CORPORATION PLC (GB) 2010-05-06 — — WO disclosed
WO-2010029313-A1 ANTIINFECTIVE COMPOUNDS SUMMIT CORPORATION PLC. (GB) 2010-03-18 — — WO disclosed
WO-2010015815-A2 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS SUMMIT CORPORATION PLC (GB) 2010-02-11 — — WO 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-20110237538-A1 TREATMENT OF LYSOSOMAL STORAGE DISORDERS AND OTHER PROTEOSTATIC DISEASES GAA, MAN2B1, GBA1 GBA1 3/4885FUCA1 17/4885GLB1 33/4885
US-20110195929-A1 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS GPI, GALE, HAVCR2 GBA1 18/4885FUCA1 83/4885GLB1 211/4885

“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.

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