SCHEMBL6108764

SCHEMBL6108764

Ic1nc2ccccc2n1CCCOC1CCCCO1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.45
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TGFBR1 P36897 2/20 0.40
▸ P2RX3 P56373 5/20 0.40
▸ TP53 P04637 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ PTAFR P25105 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TGFBR2 P37173 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ L3MBTL1 Q9Y468 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
SCHEMBL29832042 0.81 TGFBR1 (0.56) KDM4CMEN1KMT2ATGFBR1LMNA
SCHEMBL8197550 0.79 SIGMAR1 (0.49) KDM4CMEN1KMT2ATGFBR1P2RX3
SCHEMBL18834589 0.78 SLC9A1 (0.48) KDM4CMEN1KMT2ALMNANPC1
SCHEMBL6947360 0.76 SMN1; SMN2 (0.45) KDM4CMEN1KMT2ATP53LMNA
SCHEMBL4021549 0.76 MEN1 (0.48) KDM4CMEN1KMT2A
SCHEMBL8195016 0.75 MEN1 (0.46) KDM4CMEN1KMT2AP2RX3
SCHEMBL5710973 0.74 MEN1 (0.48) KDM4CMEN1KMT2ATGFBR1P2RX3
SCHEMBL4823935 0.71 TGFBR1 (0.50) KDM4CMEN1KMT2ATGFBR1P2RX3
SCHEMBL4813068 0.70 TGFBR1 (0.55) KDM4CMEN1KMT2ATGFBR1TP53
SCHEMBL7877948 0.70 MTNR1A (0.50) KDM4CMEN1KMT2A

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-20060058295-A1 Novel compounds as pharmaceutical agents ELI LILLY AND COMPANY (US) 2006-03-16 — — 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-20060058295-A1 Novel compounds as pharmaceutical agents TGFB1, TGFB2, TGFBR1 KDM4C 4678/4885MEN1 404/4885KMT2A 4380/4885

“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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