SCHEMBL29832042

SCHEMBL29832042

c1ccc2c(c1)ncn2CCCOC1CCCCO1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 2/20 0.56
▸ LMNA P02545 6/20 0.56
▸ HTT P42858 4/20 0.56
▸ TSHR P16473 2/20 0.56
▸ NPSR1 Q6W5P4 2/20 0.56
▸ SMN1; SMN2 Q16637 8/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ TGFBR2 P37173 1/20 0.52
▸ MAPT P10636 5/20 0.50
▸ HPGD P15428 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ NFKB2 Q00653 1/20 0.50
▸ RELA Q04206 1/20 0.50
▸ STAT3 P40763 1/20 0.49
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ ADRA2A P08913 1/20 0.47

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
SCHEMBL4813068 0.87 TGFBR1 (0.55) TGFBR1LMNAHTTTSHRNPSR1
SCHEMBL31173779 0.85 LMNA (0.54) TGFBR1LMNAHTTTSHRNPSR1
SCHEMBL4823935 0.85 TGFBR1 (0.50) TGFBR1LMNAHTTTSHRNPSR1
SCHEMBL6108764 0.81 KDM4C (0.45) TGFBR1LMNAHTTSMN1; SMN2TGFBR2
SCHEMBL18834589 0.79 SLC9A1 (0.48) LMNATSHRMAPTNPC1RAB9A
SCHEMBL24041864 0.78 HTT (0.53) TGFBR1LMNAHTTTSHRNPSR1
SCHEMBL8197550 0.78 SIGMAR1 (0.49) TGFBR1HTTTSHRALOX15NPC1
SCHEMBL24041867 0.76 LTA4H (0.49) LMNAHTTTSHRNPSR1SMN1; SMN2
SCHEMBL5710973 0.75 MEN1 (0.48) TGFBR1TGFBR2NPC1RAB9AMEN1
SCHEMBL7460409 0.75 MEN1 (0.46) TGFBR1LMNASMN1; SMN2TGFBR2NPC1

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-20220249680-A1 ANTIBODY-ALK5 INHIBITOR CONJUGATES AND THEIR USES SYNTHIS THERAPEUTICS, INC. (US) 2022-08-11 — — 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-20220249680-A1 ANTIBODY-ALK5 INHIBITOR CONJUGATES AND THEIR USES ALK, ALKBH5, ALKBH3 TGFBR1 528/4885LMNA 3572/4885HTT 4105/4885

“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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