SCHEMBL17825614

SCHEMBL17825614

COc1ccc(COc2cc(Cl)nc3c(F)ccc(C)c23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PDE2A O00408 1/20 0.39
APP P05067 5/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CSF1R P07333 2/20 0.36
NTRK1 P04629 1/20 0.36
NTRK3 Q16288 1/20 0.36
NTRK2 Q16620 1/20 0.36
RHEB Q15382 1/20 0.36
MAOB P27338 2/20 0.36
MAOA P21397 1/20 0.36
P2RX7 Q99572 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL17825587 0.81 MAPT (0.45) NPC1RAB9ALMNAMAPTP2RX7
SCHEMBL313616 0.77 NPC1 (0.41) NPC1RAB9APDE2AAPPLMNA
SCHEMBL26731735 0.76 MAPT (0.48) NPC1RAB9APDE2ALMNAMAPT
SCHEMBL313189 0.76 CSF1R (0.44) NPC1RAB9APDE2AAPPLMNA
SCHEMBL21828758 0.75 NPC1 (0.35) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL19813236 0.75 F9 (0.46) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL17825660 0.74 F9 (0.41) NPC1RAB9APDE2ALMNAMAPT
SCHEMBL26731927 0.74 NPC1 (0.43) NPC1RAB9APDE2AAPPLMNA
SCHEMBL31517904 0.73 NPC1 (0.47) NPC1RAB9APDE2AAPPLMNA
SCHEMBL312965 0.72 CSF1R (0.43) NPC1RAB9APDE2AAPPLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3229801-B1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME (US) 2020-04-01 EP disclosed
EP-3229801-B1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME (US) 2020-04-01 EP disclosed
US-10189819-B2 Factor IXa inhibitors MERCK SHARP & DOHME, CORP. (US) 2019-01-29 US disclosed
US-20180030036-A1 Factor IXa Inhibitors MERCK SHARP & DOHME CORP. (US) 2018-02-01 US disclosed
US-20180030036-A1 Factor IXa Inhibitors MERCK SHARP & DOHME CORP. (US) 2018-02-01 US disclosed
EP-3229801-A1 FACTOR IXA INHIBITORS Merck Sharp & Dohme Corp. (US) 2017-10-18 EP disclosed
WO-2016094260-A1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-06-16 WO disclosed
WO-2016094260-A1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-06-16 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 (2 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-20180030036-A1 Factor IXa Inhibitors F9, TFPI, F12 NPC1 701/4885RAB9A 185/4885PDE2A 1235/4885
US-10189819-B2 Factor IXa inhibitors F9, TFPI, F12 NPC1 701/4885RAB9A 185/4885PDE2A 1235/4885

“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.