SCHEMBL19504487

SCHEMBL19504487

CC(C)N1Cc2ccc(N3CCOCC3)nc2C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.40
▸ GAA P10253 3/20 0.40
▸ KMT2A Q03164 3/20 0.37
▸ HTT P42858 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ CRHBP P24387 1/20 0.36
▸ CRHR2 Q13324 1/20 0.36
▸ PIK3CA P42336 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ HRH4 Q9H3N8 1/20 0.36
▸ PIK3R1 P27986 1/20 0.36

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
SCHEMBL17624437 0.82 HRH4 (0.46) HRH3GAAKMT2AHTTALDH1A1
SCHEMBL19498194 0.78 GAA (0.43) GAAKMT2AHTTALDH1A1SMN1; SMN2
SCHEMBL19674850 0.75 HRH4 (0.43) HRH3GAAKMT2AHTTALDH1A1
SCHEMBL19504486 0.75 PDE10A (0.37) HRH3
SCHEMBL8203593 0.74 ALDH1A1 (0.45) GAAKMT2AHTTALDH1A1SMN1; SMN2
SCHEMBL7006047 0.74 ALDH1A1 (0.45) GAAHTTALDH1A1SMN1; SMN2KDM4E
SCHEMBL27251619 0.72 EGFR (0.32) KDM4EHPGDHSD17B10
SCHEMBL20651755 0.70 DRD2 (0.33) SMN1; SMN2MAPT
SCHEMBL20651750 0.70 KCNH2 (0.32) —
SCHEMBL4009586 0.69 HTR2C (0.63) HRH3GAAHTTALDH1A1KDM4E

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-20170305922-A1 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-10-26 — — 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-20170305922-A1 CARM1 INHIBITORS AND USES THEREOF CARM1, ADRM1, PRMT1 HRH3 2943/4885GAA 1620/4885KMT2A 87/4885

“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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