SCHEMBL17306708

SCHEMBL17306708

COc1cc(C(C)(C)C)nc(NC2CNC2)n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 1/20 0.39
▸ CRBN Q96SW2 1/20 0.39
▸ EHMT2 Q96KQ7 6/20 0.38
▸ AGER Q15109 1/20 0.36
▸ CYP1A2 P05177 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ CCR4 P51679 1/20 0.33
▸ FLT3 P36888 2/20 0.32
▸ NRAS P01111 1/20 0.32
▸ JAK1 P23458 1/20 0.32

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
SCHEMBL17342210 0.85 CCNT1 (0.33) EHMT2AGERCYP1A2CYP2D6CYP2C9
SCHEMBL17308279 0.81 HTT (0.46) DDB1CRBNEHMT2CYP1A2ALDH1A1
SCHEMBL17306714 0.77 MCHR1 (0.38) —
SCHEMBL17300808 0.74 HRH4 (0.42) EHMT2FLT3NRAS
SCHEMBL17306717 0.74 HRH3 (0.34) FLT3
SCHEMBL13015041 0.71 DDB1 (0.50) DDB1CRBNEHMT2CYP1A2ALDH1A1
Hydrochloric Acid SCHEMBL3776452 0.70 DDB1 (0.49) DDB1CRBNEHMT2CYP1A2ALDH1A1
SCHEMBL17300826 0.69 HRH3 (0.39) FLT3
SCHEMBL17300794 0.66 NPSR1 (0.37) FLT3NRAS
SCHEMBL17300778 0.66 HRH3 (0.34) FLT3

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-9604930-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2017-03-28 — — US disclosed
US-9604930-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2017-03-28 — — US disclosed
US-20150344434-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-12-03 — — 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-20150344434-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT3 DDB1 939/4885CRBN 1219/4885EHMT2 25/4885

“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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