SCHEMBL17342210

SCHEMBL17342210

CC(C)Oc1cc(C(C)(C)C)nc(NC2CNC2)n1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ EHMT2 Q96KQ7 1/20 0.31
▸ MAPK14 Q16539 1/20 0.31
▸ AGER Q15109 1/20 0.30

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
SCHEMBL17306708 0.85 DDB1 (0.39) CYP1A2CYP2D6CYP2C9CYP2C19EHMT2
SCHEMBL17345633 0.82 MEN1 (0.49) CCNT1CDK9MEN1CYP1A2POLB
SCHEMBL17300778 0.76 HRH3 (0.34) CCNT1CDK9
SCHEMBL17306714 0.74 MCHR1 (0.38) CCNT1CDK9MAPK14
SCHEMBL17306717 0.71 HRH3 (0.34) CCNT1CDK9
SCHEMBL17194952 0.69 HMGCR (0.36) MEN1CYP1A2POLBCYP2D6CYP2C9
SCHEMBL17300826 0.66 HRH3 (0.39) CCNT1CDK9
SCHEMBL17308279 0.66 HTT (0.46) MEN1CYP1A2KMT2ASMN1; SMN2EHMT2
SCHEMBL13927358 0.66 PDE4A (0.43) MEN1CYP2C9CYP2C19KMT2ASMN1; SMN2
SCHEMBL17300808 0.66 HRH4 (0.42) EHMT2

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-20150361042-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-12-17 — — 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-20150361042-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 CCNT1 2654/4885CDK9 339/4885MEN1 1416/4885

“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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