SCHEMBL2386480

SCHEMBL2386480

CC1=NNc2ccccc2C=C1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
GAA P10253 1/20 0.48
P2RX4 Q99571 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL9934859 0.75 GAA (0.48) MAPTGAA
SCHEMBL30082351 0.75 GAA (0.48) MAPTGAA
SCHEMBL3113175 0.75 GAA (0.48) MAPTGAA
SCHEMBL1505206 0.75 GAA (0.48) MAPTGAA
SCHEMBL31695999 0.75 GAA (0.48) MAPTGAA
SCHEMBL8119025 0.75 GAA (0.48) MAPTGAA
SCHEMBL8554754 0.75 GAA (0.48) MAPTGAA
SCHEMBL3241604 0.75 MAPT (0.48) MAPTGAAP2RX4RAB9ASMN1; SMN2
SCHEMBL11428738 0.75 GAA (0.48) MAPTGAA
SCHEMBL8799466 0.75 GAA (0.43) MAPTGAAP2RX4

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4663454-A Process to prepare α-chloroalprazolam THE UPJOHN COMPANY (US) 1987-05-05 US claimed
CN-104684981-B For producing the polycarbonate compositions of the optical quality product with high-quality and good workability 沙特基础全球技术有限公司 2016-10-19 CN disclosed
US-9023818-B2 Pharmaceutical agents containing carbohydrate moieties and methods of their preparation and use GLYCON LLC (US) 2015-05-05 US disclosed
US-20140057869-A9 Novel Pharmaceutical Agents Containing Carbohydrate Moieties And Methods Of Their Preparation And Use IMI INTERNATIONAL MEDICAL INNOVATIONS, INC. 2014-02-27 US disclosed
US-20110237544-A1 Novel Pharmaceutical Agents Containing Carbohydrate Moieties And Methods Of Their Preparation And Use CHRISTIAN SAMUEL T 2011-09-29 US disclosed
US-20090062256-A1 LACTAMS SUBSTITUTED BY CYCLIC SUCCINATES AS INHIBITORS OF Abeta PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2009-03-05 US disclosed
US-7456278-B2 Lactams substituted by cyclic succinates as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA CORPORATION (US) 2008-11-25 US disclosed
US-20080103128-A1 LACTAMS SUBSTITUTED BY CYCLIC SUCCINATES AS INHIBITORS OF ABETTA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-05-01 US disclosed
US-7354914-B2 Lactams substituted by cyclic succinates as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-04-08 US disclosed
US-20060189547-A1 Novel pharmaceutical agents containing carbohydrate moieties and methods of their preparation and use CHRISTIAN SAMUEL T 2006-08-24 US disclosed
CN-1128264-A Crystalline form of dihydro-2,3-benzodiazepine derivative LILLY CO ELI (US) 1996-08-07 CN disclosed
EP-0597540-B1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC (US) 1996-06-05 EP disclosed
CN-1123282-A Stereoselective process for producing dihydro-2,3-benzodiazepine derivatives LILLY CO ELI (US) 1996-05-29 CN disclosed
CN-1122338-A Physical form of dihydro-2,3-benzodiazepine derivative LILLY CO ELI (US) 1996-05-15 CN disclosed
WO-1996006606-A1 DIHYDRO-2,3-BENZODIAZEPINE DERIVATIVES ELI LILLY AND COMPANY (US) 1996-03-07 WO disclosed
EP-0699676-A1 Physical form of dihidro-2,3-benzodiazepine derivative ELI LILLY AND COMPANY (US) 1996-03-06 EP disclosed
EP-0699677-A1 Stereoselective process for producing dihydro-2,3-benzodiazepine derivatives ELI LILLY AND COMPANY (US) 1996-03-06 EP disclosed
US-5380721-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0597540-A1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1994-05-18 EP disclosed
EP-0475527-A2 Aryl-fused and hetaryl-fused-2, 4-diazepine and 2, 4-diazocine antiarrhythmic agents STERLING DRUG INC. (US) 1992-03-18 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 (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-20060189547-A1 Novel pharmaceutical agents containing carbohydrate moieties and methods of their preparation and use CSGALNACT1, DDOST, STT3B MAPT 90/4885GAA 184/4885P2RX4 2421/4885
US-20090062256-A1 LACTAMS SUBSTITUTED BY CYCLIC SUCCINATES AS INHIBITORS OF Abeta PROTEIN PRODUCTION BACE1, APP, APH1A MAPT 47/4885GAA 253/4885P2RX4 4248/4885
US-20080103128-A1 LACTAMS SUBSTITUTED BY CYCLIC SUCCINATES AS INHIBITORS OF ABETTA PROTEIN PRODUCTION APH1A, APH1B, APP MAPT 105/4885GAA 115/4885P2RX4 4170/4885
US-20110237544-A1 Novel Pharmaceutical Agents Containing Carbohydrate Moieties And Methods Of Their Preparation And Use CSGALNACT1, DDOST, STT3B MAPT 90/4885GAA 184/4885P2RX4 2421/4885
US-20140057869-A9 Novel Pharmaceutical Agents Containing Carbohydrate Moieties And Methods Of Their Preparation And Use CSGALNACT1, DDOST, STT3B MAPT 90/4885GAA 184/4885P2RX4 2421/4885

“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.