SCHEMBL15070855

SCHEMBL15070855

CC(C)c1snc2cccnc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 4/20 0.35
NPC1 O15118 4/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
PRMT5 O14744 1/20 0.35
IDO1 P14902 3/20 0.35
KDM4E B2RXH2 5/20 0.34
HTT P42858 3/20 0.34
LMNA P02545 3/20 0.34
MAPT P10636 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
HIF1A Q16665 2/20 0.34
GMNN O75496 1/20 0.34
TP53 P04637 1/20 0.34
MMP2 P08253 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
MMP9 P14780 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34

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
SCHEMBL4069439 0.75 HSP90AA1 (0.43) HSP90AA1NPC1L3MBTL1PRMT5KDM4E
SCHEMBL21139553 0.72 KDM4E (0.39) HSP90AA1NPC1L3MBTL1PRMT5KDM4E
SCHEMBL13656961 0.71 GPR3 (0.36) L3MBTL1KDM4EHTTMAPTTDP1
SCHEMBL4072413 0.71 PRMT5 (0.42) HSP90AA1NPC1L3MBTL1PRMT5IDO1
SCHEMBL23495082 0.71 KDM4E (0.38) HSP90AA1NPC1L3MBTL1PRMT5KDM4E
SCHEMBL18878959 0.70 POLB (0.36) HSP90AA1NPC1L3MBTL1PRMT5IDO1
SCHEMBL16417612 0.70 POLB (0.36) HSP90AA1NPC1L3MBTL1PRMT5IDO1
SCHEMBL19957787 0.70 NPC1 (0.35) HSP90AA1NPC1L3MBTL1IDO1KDM4E
SCHEMBL15935231 0.70 HSP90AA1 (0.35) HSP90AA1NPC1L3MBTL1PRMT5KDM4E
SCHEMBL14682709 0.68 HSP90AA1 (0.45) HSP90AA1NPC1L3MBTL1IDO1KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023173083-A1 TETRAHYDROINDOLE DERIVATIVES AS EGFR AND/OR HER2 INHIBTORS USEFUL FOR THE TREATMENT OF CANCER SCORPION THERAPEUTICS, INC. (US) 2023-09-14 WO disclosed
US-10307413-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2019-06-04 US disclosed
US-20170334861-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-11-23 US disclosed
US-20130165483-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 US disclosed
US-20130165472-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 US disclosed
US-20130165464-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 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 (5 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-20130165472-A1 HETEROARYLS AND USES THEREOF PIK3R4, VPS4B, PIK3C2A HSP90AA1 410/4885NPC1 330/4885L3MBTL1 1598/4885
US-20130165483-A1 HETEROARYLS AND USES THEREOF PIK3R5, PIK3R4, PIK3C2B HSP90AA1 1168/4885NPC1 304/4885L3MBTL1 196/4885
US-10307413-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof PRMT5, PRMT1, PRMT3 HSP90AA1 4331/4885NPC1 2147/4885L3MBTL1 1306/4885
US-20170334861-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT3 HSP90AA1 4331/4885NPC1 2147/4885L3MBTL1 1306/4885
US-20130165464-A1 HETEROARYLS AND USES THEREOF PIK3C2B, PI4KB, PIK3R4 HSP90AA1 1599/4885NPC1 819/4885L3MBTL1 866/4885

“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.