SCHEMBL13132553

SCHEMBL13132553

CCCCCCCCCCCCC#Cc1cccc(NC(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.48
▸ SAE1 Q9UBE0 1/20 0.48
▸ UBA2 Q9UBT2 1/20 0.48
▸ NR1H4 Q96RI1 4/20 0.47
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ MITF O75030 2/20 0.46
▸ PAX8 Q06710 1/20 0.46
▸ MMP2 P08253 1/20 0.45
▸ MMP12 P39900 1/20 0.45
▸ EPHX1 P07099 4/20 0.43
▸ FFAR1 O14842 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL13132713 0.98 MAPT (0.48) MAPTSAE1UBA2NR1H4NPC1
SCHEMBL13132557 0.95 RAB9A (0.48) MAPTSAE1UBA2NR1H4NPC1
SCHEMBL13132544 0.86 NPC1 (0.52) MAPTNPC1RAB9ASMN1; SMN2MITF
SCHEMBL13023081 0.80 THRB (0.45) MAPTSAE1UBA2NR1H4MMP2
SCHEMBL13132548 0.80 NPC1 (0.50) MAPTNPC1RAB9ASMN1; SMN2MITF
SCHEMBL13132571 0.79 PTPN11 (0.61) MAPTNPC1RAB9ASMN1; SMN2MITF
SCHEMBL13022965 0.78 NR1H4 (0.44) MAPTSAE1UBA2NR1H4MMP2
SCHEMBL13168717 0.78 RAB9A (0.47) MAPTNPC1RAB9ASMN1; SMN2MITF
SCHEMBL13400501 0.77 KCNK3 (0.46) MAPTSAE1UBA2NR1H4ALDH1A1
SCHEMBL13132700 0.77 NPC1 (0.50) MAPTNPC1RAB9ASMN1; SMN2MITF

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-20100240908-A1 ACETYLENE COMPOUND FUJIFILM CORPORATION (JP) 2010-09-23 — — 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-20100240908-A1 ACETYLENE COMPOUND NAT1, KATNA1, KAT2B MAPT 4057/4885SAE1 419/4885UBA2 997/4885

“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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