SCHEMBL5678993

SCHEMBL5678993

CCCCCCCCNc1ccc(CCC)c2cc(O)c(O)cc12

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ ALOX5 P09917 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ IDO1 P14902 1/20 0.41
▸ CNR1 P21554 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ NAAA Q02083 1/20 0.39
▸ TRPV1 Q8NER1 2/20 0.38
▸ HCAR3 P49019 1/20 0.38
▸ GPR84 Q9NQS5 3/20 0.37
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL5677780 0.94 TYR (0.45) TYRMEN1MAPTKMT2ATP53
SCHEMBL5676824 0.82 IDO1 (0.43) MAPTIDO1CNR1CNR2NAAA
SCHEMBL5919773 0.78 PRKCI (0.46) TYRMEN1MAPTKMT2ATP53
SCHEMBL5678097 0.75 CNR1 (0.38) HTTIDO1CNR1CNR2NAAA
SCHEMBL5680114 0.73 TYR (0.53) TYRMEN1MAPTKMT2ATP53
SCHEMBL9464309 0.72 IDO1 (0.56) MAPTCYP3A4TSHRIDO1CNR1
SCHEMBL4642633 0.71 IDO1 (0.78) MEN1MAPTKMT2ATSHRIDO1
SCHEMBL8943087 0.70 NAAA (0.45) TYRIDO1CNR1CNR2NAAA
SCHEMBL1789729 0.70 NAAA (0.45) TYRIDO1CNR1CNR2NAAA
SCHEMBL7549269 0.70 ABL1 (0.44) MEN1MAPTKMT2AHTTNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III ZHAO BAIYI 2006-02-16 — — US disclosed
EP-1620447-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III Exxonmobil Chemical Patents Inc. (US) 2006-02-01 — — EP disclosed
WO-2003102006-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-12-11 — — 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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III COMT, CD69, SPR TYR 275/4885MEN1 3718/4885MAPT 1188/4885

“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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