SCHEMBL273091

SCHEMBL273091

CCCOc1cc(C=O)cc(OCCC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
AHR P35869 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
PLA2G2A P14555 1/20 0.41
ERN1 O75460 2/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 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
SCHEMBL14316911 0.96 ALDH1A1 (0.44) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL24993379 0.93 AHR (0.53) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL5883712 0.90 AHR (0.53) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL1851590 0.89 ALDH1A1 (0.38) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL22910274 0.88 PLA2G2A (0.54) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL11949127 0.87 ALDH1A1 (0.39) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL3230270 0.87 KAT6A (0.40) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL6847389 0.86 PLA2G2A (0.57) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL10497527 0.86 PLA2G2A (0.57) ALDH1A1LMNAMAPTHPGDSMN1; SMN2
SCHEMBL6851550 0.86 PLA2G2A (0.57) ALDH1A1LMNAMAPTHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023010191-A1 N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS EUROFARMA LABORATÓRIOS S.A. (BR) 2023-02-09 WO disclosed
US-8133898-B2 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-13 US disclosed
US-20100137310-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-03 US disclosed
WO-2008121506-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-10-09 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 (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-20100137310-A1 RENIN INHIBITORS REN, ACE, PRSS3 ALDH1A1 1131/4885LMNA 1313/4885MAPT 3373/4885

“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.