SCHEMBL4744526

SCHEMBL4744526

CCc1nc2c(Br)cccc2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.44
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.44
RAB9A P51151 1/20 0.44
LIPG Q9Y5X9 1/20 0.44
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TLR8 Q9NR97 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
ALDH1A1 P00352 5/20 0.37
GRM2 Q14416 3/20 0.37
CXCR6 O00574 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 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
SCHEMBL27921993 0.81 TLR8 (0.44) LIPGMAPTL3MBTL1TLR8TLR7
SCHEMBL27997436 0.81 L3MBTL1 (0.42) MAPK1NPC1RAB9ALIPGMAPT
SCHEMBL11834129 0.80 MEN1 (0.51) MAPK1NPC1GAARAB9AMAPT
SCHEMBL805050 0.80 ALDH1A1 (0.58) MAPK1NPC1GAARAB9AMAPT
Ammonia Solution, Strong SCHEMBL28528068 0.79 MEN1 (0.50) MAPK1NPC1GAARAB9AMAPT
SCHEMBL7218454 0.79 SMN1; SMN2 (0.56) MAPK1NPC1GAARAB9AMAPT
SCHEMBL6630437 0.79 LMNA (0.56) MAPK1NPC1GAARAB9AMAPT
SCHEMBL11371897 0.79 GAA (0.44) MAPK1NPC1GAARAB9AMAPT
SCHEMBL28015724 0.79 GAA (0.44) MAPK1NPC1GAARAB9AMAPT
SCHEMBL18285791 0.78 LIPG (0.49) RAB9ALIPGMAPTL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230144106-A1 COMPOUNDS FOR THE MODULATION OF MYC ACTIVITY SYROS PHARMACEUTICALS INC (US) 2023-05-11 US disclosed
CN-110305136-A A kind of pemetrexed disodium intermediate and preparation method thereof 鲁南制药集团股份有限公司 2019-10-08 CN disclosed
CN-110305137-A A kind of pemetrexed disodium intermediate and preparation method thereof 鲁南制药集团股份有限公司 2019-10-08 CN disclosed
WO-2008104875-A1 OXAZOLIDINONES AS CHOLESTEROL ABSORPTION INHIBITORS PFIZER PRODUCTS INC. (US) 2008-09-04 WO 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-20230144106-A1 COMPOUNDS FOR THE MODULATION OF MYC ACTIVITY MYC, MYCBP, MYCBP2 MAPK1 847/4885NPC1 649/4885GAA 2507/4885

“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.