SCHEMBL19086214

SCHEMBL19086214

Cc1cc2c(s1)CCN(C(=O)CNC(=O)c1ccc3[nH]ncc3c1)C2

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.48
MAOB P27338 4/20 0.43
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CTNNB1 P35222 1/20 0.41
WNT3A P56704 1/20 0.41
ROCK2 O75116 2/20 0.41
ROCK1 Q13464 1/20 0.41
P2RY12 Q9H244 1/20 0.40
THRB P10828 1/20 0.39
VDR P11473 1/20 0.39
MAPK14 Q16539 1/20 0.38
DDR1 Q08345 2/20 0.38
ACACB O00763 2/20 0.38
ACACA Q13085 1/20 0.38

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
SCHEMBL19086026 0.89 METTL3 (0.44) METTL3MAOBALDH1A1L3MBTL1HTT
SCHEMBL19086185 0.88 METTL3 (0.43) METTL3MAOBALDH1A1L3MBTL1HTT
SCHEMBL19086190 0.84 ROCK2 (0.48) METTL3ROCK2ROCK1MAPK14
SCHEMBL19086351 0.83 MAOB (0.44) METTL3MAOBHTTSMN1; SMN2ROCK2
SCHEMBL19086995 0.83 ROCK2 (0.47) METTL3MAOBALDH1A1HTTSMN1; SMN2
SCHEMBL19086209 0.83 ROCK2 (0.43) METTL3MAOBALDH1A1L3MBTL1HTT
SCHEMBL19086223 0.82 METTL3 (0.43) METTL3MAOBALDH1A1CTNNB1WNT3A
SCHEMBL19086249 0.82 ROCK2 (0.50) METTL3HTTSMN1; SMN2ROCK2ROCK1
SCHEMBL19086259 0.82 METTL3 (0.42) METTL3MAOBHTTSMN1; SMN2ROCK2
SCHEMBL19086198 0.81 HDAC6 (0.38) METTL3MAOBALDH1A1L3MBTL1HTT

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
WO-2017114275-A1 COMPOUND FOR INHIBITING ROCK, PREPARATION METHOD AND USE OF SAME 成都先导药物开发有限公司 2017-07-06 WO disclosed
US-20150290228-A1 ORAL FORMULATIONS OF CYTIDINE ANALOGS AND METHODS OF USE THEREOF CELGENE CORPORATION 2015-10-15 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-20150290228-A1 ORAL FORMULATIONS OF CYTIDINE ANALOGS AND METHODS OF USE THEREOF BCL6, BCL3, BCL9 METTL3 269/4885MAOB 1158/4885ALDH1A1 4148/4885

“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.