SCHEMBL13490774

SCHEMBL13490774

CCc1cc(OC)cc(OCC(=O)N(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ POLB P06746 2/20 0.45
▸ MAPK1 P28482 2/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TACR1 P25103 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ KEAP1 Q14145 1/20 0.39
▸ NFE2L2 Q16236 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL13490812 0.81 PPARA (0.49) SMN1; SMN2MAPK1ALDH1A1KDM4ETP53
SCHEMBL13490773 0.78 KMT2A (0.45) SMN1; SMN2POLBMAPK1ALDH1A1KDM4E
SCHEMBL4487061 0.78 SMN1; SMN2 (0.56) SMN1; SMN2POLBMAPK1RAB9ALMNA
SCHEMBL791810 0.78 LMNA (0.68) SMN1; SMN2POLBMAPK1RAB9AALDH1A1
SCHEMBL13189262 0.77 CALM1 (0.50) MAPK1ALDH1A1
SCHEMBL4477658 0.77 SMN1; SMN2 (0.63) SMN1; SMN2MAPK1RAB9AALDH1A1KDM4E
SCHEMBL88823 0.75 ALDH1A1 (0.61) POLBMAPK1ALDH1A1KMT2A
SCHEMBL5393479 0.74 LMNA (0.53) SMN1; SMN2ALDH1A1HPGDHSD17B10LMNA
SCHEMBL12903697 0.72 MAOB (0.47) ALDH1A1
SCHEMBL13490816 0.72 FFAR1 (0.54) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029647-A1 3,4,(5)-SUBSTITUTED TETRAHYDROPHYRIDINES NOVARTIS AG (CH) 2010-02-04 — — 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-20100029647-A1 3,4,(5)-SUBSTITUTED TETRAHYDROPHYRIDINES REN, PAH, ACE SMN1; SMN2 2582/4885POLB 3495/4885MAPK1 2507/4885

“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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