SCHEMBL918685

SCHEMBL918685

CCNC(=O)c1ccc(OC)c(OC)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.64
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
TP53 P04637 1/20 0.62
POLB P06746 1/20 0.61
HDAC3 O15379 1/20 0.60
HDAC2 Q92769 1/20 0.60
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
TSHR P16473 1/20 0.59
CYP2C19 P33261 1/20 0.59
ROCK2 O75116 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
GAA P10253 1/20 0.58
HTT P42858 1/20 0.58
CA12 O43570 1/20 0.58

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
Hydrochloric Acid SCHEMBL9638632 0.98 NR1H4 (0.62) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL13753805 0.91 TP53 (0.77) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL930908 0.87 ROCK2 (0.76) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL15434476 0.87 TAS1R3 (0.63) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL17676475 0.87 LMNA (0.54) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL25022849 0.87 TAS1R3 (0.56) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL13216467 0.87 RAB9A (0.62) RAB9AMEN1KMT2ATP53POLB
SCHEMBL90417 0.87 TP53 (0.67) NR1H4RAB9AMEN1KMT2ATP53
SCHEMBL1931948 0.85 L3MBTL1 (0.59) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL13702311 0.85 LMNA (0.52) NR1H4NPC1RAB9ATP53LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015108-A1 Aqueous Buffered Fluoride-Containing Etch Residue Removers and Cleaners AIR PRODUCTS AND CHEMICALS, INC. (US) 2011-01-20 US claimed
US-7807613-B2 Aqueous buffered fluoride-containing etch residue removers and cleaners AIR PRODUCTS AND CHEMICALS, INC. (US) 2010-10-05 US claimed
US-20040266637-A1 Aqueous buffered fluoride-containing etch residue removers and cleaners VERSUM MATERIALS US, LLC 2004-12-30 US claimed
US-20230303514-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2023-09-28 US disclosed
EP-3889146-A1 POLYHETEROCYCLIC TLR7/8 ANTAGONISTS AND THEIR USES FOR TREATING IMMUNE DISORDERS Merck Patent GmbH (DE) 2021-10-06 EP disclosed
WO-2017106607-A1 POLYCYCLIC TLR7/8 ANTAGONISTS AND USE THEREOF IN THE TREATMENT OF IMMUNE DISORDERS MERCK PATENT GMBH (DE) 2017-06-22 WO disclosed
US-20170174653-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2017-06-22 US disclosed
US-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed
US-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed
CN-101489988-A Process for alkenylation of carboxamides BASF AG (DE) 2009-07-22 CN disclosed
US-20090131657-A1 PROCESS FOR ALKENYLATING CARBOXAMIDES BASF SE (DE) 2009-05-21 US disclosed
US-7390830-B1 Remedies or prophylactics for diseases in association with chemokines TEIJIN LIMITED (JP) 2008-06-24 US disclosed
US-5378702-A Thiadizinones MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-01-03 US disclosed
CN-1084172-A Thiadiazinone MERCK PATENT GMBH (DE) 1994-03-23 CN disclosed
EP-0579077-A2 1,3,4-Thiadiazinones for the treatment of cardiovascular diseases MERCK PATENT GmbH (DE) 1994-01-19 EP 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 (3 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-20230303514-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 NR1H4 36/4885NPC1 239/4885RAB9A 774/4885
US-20170174653-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 NR1H4 47/4885NPC1 392/4885RAB9A 903/4885
US-20090131657-A1 PROCESS FOR ALKENYLATING CARBOXAMIDES PRMT5, CYC1, CBR3 NR1H4 3173/4885NPC1 3667/4885RAB9A 3925/4885

“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.