SCHEMBL4834567

SCHEMBL4834567

Cn1ncc(C=CC(=O)O)c1-c1ccco1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 1/20 0.45
▸ KDM4E B2RXH2 7/20 0.45
▸ RAB9A P51151 6/20 0.45
▸ NPC1 O15118 5/20 0.45
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ ALDH1A1 P00352 5/20 0.45
▸ HPGD P15428 4/20 0.45
▸ CCNC P24863 1/20 0.42
▸ CDK8 P49336 1/20 0.42
▸ PTGS1 P23219 4/20 0.41
▸ MAPT P10636 5/20 0.40
▸ LMNA P02545 3/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ SENP8 Q96LD8 1/20 0.40
▸ SENP7 Q9BQF6 1/20 0.40
▸ SENP6 Q9GZR1 1/20 0.40
▸ MASP2 O00187 1/20 0.39
▸ F2 P00734 1/20 0.39
▸ HCRTR1 O43613 1/20 0.39
▸ TP53 P04637 2/20 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
SCHEMBL4834558 1.00 HCAR2 (0.45) HCAR2KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL4831166 0.81 ERN1 (0.41) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL4829106 0.79 PTGS1 (0.54) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL4829098 0.79 PTGS1 (0.54) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL4834262 0.76 HCAR2 (0.45) HCAR2KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL4834248 0.76 HCAR2 (0.45) HCAR2KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL4836324 0.74 MAPT (0.41) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL4836344 0.74 MAPT (0.41) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL11606838 0.74 ALDH1A1 (0.40) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL4831287 0.74 MAPT (0.38) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287438-A1 Agent for preventing or treating neuropathy MOMOSE YU 2008-11-20 — — US disclosed
US-7423159-B2 Agent for preventing or treating neuropathy TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-09-09 — — US disclosed
US-20060004069-A1 Agent for preventing or treating neuropathy TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-05 — — US disclosed
EP-1556032-A1 AGENT FOR PREVENTING OR TREATING NEUROPATHY Takeda Pharmaceutical Company Limited (JP) 2005-07-27 — — EP disclosed
WO-2004039365-A1 AGENT FOR PREVENTING OR TREATING NEUROPATHY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-13 — — 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-20060004069-A1 Agent for preventing or treating neuropathy NR2C2, NR0B2, NR2E1 HCAR2 21/4885KDM4E 4406/4885RAB9A 4059/4885
US-20080287438-A1 Agent for preventing or treating neuropathy NR2C2, NR0B2, NR2E1 HCAR2 21/4885KDM4E 4406/4885RAB9A 4059/4885

“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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