SCHEMBL17754304

SCHEMBL17754304

C=CC(=O)COc1ccc(-c2ccc(OCC(=O)C=C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
MAPT P10636 3/20 0.44
RAB9A P51151 3/20 0.44
ALDH1A1 P00352 4/20 0.42
LMNA P02545 3/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
SRD5A2 P31213 1/20 0.41
ALOX15 P16050 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
THRB P10828 1/20 0.40
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
USP2 O75604 1/20 0.39
HPGD P15428 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
SCHEMBL9615542 0.94 ALOX15 (0.45) SMN1; SMN2MAPTRAB9AALDH1A1ALOX15
SCHEMBL18900966 0.91 THRB (0.49) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL2607375 0.88 MMP2 (0.55) MAPTALDH1A1GAAHPGD
SCHEMBL17754303 0.87 KMT2A (0.43) SMN1; SMN2NPC1MAPTRAB9ALMNA
SCHEMBL10029818 0.85 LMNA (0.45) SMN1; SMN2MAPTRAB9ALMNACASP3
SCHEMBL5497407 0.84 ALOX15 (0.61) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL13376460 0.83 PPARG (0.47) SMN1; SMN2NPC1MAPTRAB9ALMNA
SCHEMBL4894553 0.83 ALDH1A1 (0.58) ALDH1A1SRD5A2HTTL3MBTL1
SCHEMBL18900968 0.82 SRD5A2 (0.35) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL16450587 0.82 L3MBTL1 (0.58) SMN1; SMN2MAPTRAB9AALDH1A1LMNA

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-20160137921-A1 POLYMERIZABLE COMPOUND, AND LIQUID CRYSTAL COMPOSITION PRODUCED USING SAME DIC CORPORATION (JP) 2016-05-19 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-20160137921-A1 POLYMERIZABLE COMPOUND, AND LIQUID CRYSTAL COMPOSITION PRODUCED USING SAME RCC1, LPXN, SMC4 SMN1; SMN2 3198/4885NPC1 2708/4885MAPT 66/4885

“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.