SCHEMBL19480100

SCHEMBL19480100

CCc1ccc(C(=O)NC2CCOCC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.58
KMT2A Q03164 3/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
PLK1 P53350 1/20 0.51
MEN1 O00255 2/20 0.51
POLB P06746 2/20 0.51
NAMPT P43490 1/20 0.50
HDAC4 P56524 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
SMYD3 Q9H7B4 1/20 0.49
HPGD P15428 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
BRD4 O60885 2/20 0.48
KDM1A O60341 2/20 0.47

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
SCHEMBL8272807 0.89 PLK1 (0.59) KMT2ANPC1RAB9ASMN1; SMN2PLK1
SCHEMBL13754022 0.86 NPC1 (0.66) KDM4EKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL17845249 0.86 NPC1 (0.61) KDM4EKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL507405 0.85 KDM4E (0.58) KDM4EKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL13766441 0.84 NPC1 (0.69) KDM4EKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL28901208 0.84 KDM4E (0.56) KDM4EKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL5483603 0.83 NAMPT (0.51) KDM4EKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL24529100 0.83 SMYD3 (0.72) NPC1RAB9ASMN1; SMN2SMYD3HPGD
SCHEMBL12124399 0.83 HPGD (0.71) KDM4EKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL21489911 0.82 SMYD3 (0.71) PLK1SMYD3

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-20170298075-A1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY. LTD. (AU) 2017-10-19 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-20170298075-A1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS PRMT5, PRMT1, PRMT3 KDM4E 61/4885KMT2A 38/4885NPC1 2922/4885

“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.