SCHEMBL19504489

SCHEMBL19504489

CC(C)(C)N1Cc2cc(C(F)(F)F)cnc2C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 7/20 0.39
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
SPR P35270 1/20 0.34
SSTR4 P31391 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 1/20 0.33
AGBL2 Q5U5Z8 1/20 0.33

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
SCHEMBL21560381 0.87 ABHD6 (0.30)
SCHEMBL13405615 0.86 CCR2 (0.39) SLC6A9LMNASMN1; SMN2
SCHEMBL17624441 0.81 SLC6A9 (0.41) SLC6A9LMNASMN1; SMN2SPRSSTR4
SCHEMBL22652447 0.80 KCNH2 (0.34)
SCHEMBL3879973 0.79 SLC6A9 (0.40) SLC6A9LMNASMN1; SMN2SPRALDH1A1
SCHEMBL19498190 0.78 CYP1A2 (0.32)
SCHEMBL20651758 0.76 SLC6A9 (0.43) SLC6A9SMN1; SMN2SPRALDH1A1KMT2A
SCHEMBL18702206 0.75 SLC6A9 (0.49) SLC6A9LMNASMN1; SMN2SPRSSTR4
SCHEMBL21560325 0.74 KCNH2 (0.32)
SCHEMBL20226093 0.74 CACNA1H (0.31)

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 SLC6A9 4847/4885LMNA 2796/4885SMN1; SMN2 1375/4885

“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.