SCHEMBL13301435

SCHEMBL13301435

C#CCOc1cc2ccccc2c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 8/20 0.46
▸ GPR84 Q9NQS5 1/20 0.44
▸ MAPT P10636 1/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ MAOA P21397 4/20 0.39
▸ LOXL2 Q9Y4K0 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2A6 P11509 1/20 0.39
▸ CYP1A1 P04798 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ TRPM4 Q8TD43 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ CYP1B1 Q16678 1/20 0.38
▸ HSD17B10 Q99714 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
SCHEMBL19038910 0.83 MAOB (0.44) MAOBMAPTMAOACYP1A1CYP1A2
SCHEMBL19038939 0.83 MAOB (0.53) MAOBMAPTMAOAHSD17B10
SCHEMBL19038923 0.81 CYP3A4 (0.49) MAOBMAPTMEN1KMT2AMAOA
SCHEMBL11356378 0.79 MAOB (0.44) MAOBMAPTMEN1KMT2AMAOA
SCHEMBL22820259 0.78 CYP1A1 (0.44) MAOBMEN1KMT2AMAOALOXL2
SCHEMBL30000708 0.78 HTR1B (0.55) MAOBMEN1KMT2ALOXL2CYP3A4
SCHEMBL2204213 0.78 HTR1B (0.55) MAOBMEN1KMT2ALOXL2CYP3A4
SCHEMBL10518935 0.77 MAOB (0.49) MAOBMAPTMAOALOXL2CYP3A4
SCHEMBL19038909 0.77 CYP3A4 (0.57) MAOBMAPTMAOALOXL2CYP3A4
Ammonia Solution, Strong SCHEMBL27736316 0.76 HTR1B (0.53) MAOBMEN1KMT2ALOXL2CYP3A4

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-20100143980-A1 SYNTHESIS OF NOVEL XYLOSIDES AND POTENTIAL USES THEREOF BALAGURUNATHAN KUBERAN 2010-06-10 — — US disclosed
US-20100143980-A1 SYNTHESIS OF NOVEL XYLOSIDES AND POTENTIAL USES THEREOF BALAGURUNATHAN KUBERAN 2010-06-10 — — US disclosed
WO-2008103618-A1 SYNTHESIS OF NOVEL XYLOSIDES AND POTENTIAL USES THEREOF UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2008-08-28 — — 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-20100143980-A1 SYNTHESIS OF NOVEL XYLOSIDES AND POTENTIAL USES THEREOF CSGALNACT1, ST3GAL3, FUT6 MAOB 1573/4885GPR84 4233/4885MAPT 4679/4885

“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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