SCHEMBL16943626

SCHEMBL16943626

CC[C@@H]1C[C@@H](n2ccc3c(Cl)ncnc32)C[C@@H]1C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ UBA6 A0AVT1 4/20 0.42
▸ NNMT P40261 14/20 0.36
▸ PIP4K2A P48426 1/20 0.36
▸ PRMT5 O14744 1/20 0.35
▸ WDR77 Q9BQA1 1/20 0.35

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
SCHEMBL16943624 0.89 UBA6 (0.41) UBA6NNMTPIP4K2APRMT5WDR77
SCHEMBL13170705 0.86 UBA6 (0.43) UBA6PRMT5WDR77
SCHEMBL25049137 0.80 NNMT (0.36) NNMTPIP4K2APRMT5WDR77
SCHEMBL1947419 0.78 UBA6 (0.41) UBA6NNMTPRMT5WDR77
SCHEMBL936138 0.78 UBA6 (0.41) UBA6NNMTPRMT5WDR77
SCHEMBL18589317 0.78 UBA6 (0.41) UBA6NNMTPRMT5WDR77
SCHEMBL16769947 0.77 PRMT5 (0.44) UBA6NNMTPIP4K2APRMT5WDR77
SCHEMBL23892218 0.77 PRMT5 (0.47) UBA6NNMTPIP4K2APRMT5WDR77
SCHEMBL25049134 0.76 PIP4K2A (0.46) UBA6NNMTPIP4K2APRMT5WDR77
SCHEMBL16967987 0.76 PIP4K2A (0.49) PIP4K2APRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9593121-B2 Indole substituted pyrrolopyrimidinyl inhibitors of Uba6 MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-03-14 — — US disclosed
US-20150210700-A1 INDOLE-SUBSTITUTED PYRROLOPYRIMIDINYL INHIBITORS OF UBA6 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-07-30 — — 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-20150210700-A1 INDOLE-SUBSTITUTED PYRROLOPYRIMIDINYL INHIBITORS OF UBA6 UBA6, UBE2V1, UBA1 UBA6 1/4885NNMT 1932/4885PIP4K2A 1506/4885

“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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