SCHEMBL4959255

SCHEMBL4959255

COCOc1cnccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.36
PTGS2 P35354 2/20 0.36
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
CHRNB4 P30926 2/20 0.33
CHRNA3 P32297 2/20 0.33
CLCN2 P51788 1/20 0.33
SLC6A3 Q01959 1/20 0.33
NFE2L2 Q16236 1/20 0.33
ATR Q13535 1/20 0.33
CYP17A1 P05093 1/20 0.33
AAK1 Q2M2I8 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NOTUM Q6P988 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL5699971 0.81 CA12 (0.49) PTGS1PTGS2SMN1; SMN2TDP1SLC6A2
SCHEMBL18229376 0.80 L3MBTL1 (0.47) GAAATRCYP17A1
SCHEMBL15596168 0.79 CHRNB2 (0.47) TDP1CHRNB4CHRNA3CYP17A1NOTUM
SCHEMBL15858729 0.79 CHRNB4 (0.50) PTGS1PTGS2GAASMN1; SMN2SLC6A2
SCHEMBL10549246 0.78
SCHEMBL29682155 0.78
SCHEMBL6640028 0.78 CA12 (0.39) PTGS1PTGS2SMN1; SMN2SLC6A2SLC6A4
SCHEMBL764171 0.78 CHRNB4 (0.33) CHRNB4CHRNA3CA12CA1CA2
SCHEMBL14159678 0.76 CA12 (0.49) GAASMN1; SMN2SLC6A2SLC6A4CHRNB4
SCHEMBL31139331 0.75 CYP11B1 (0.41) CHRNB4CHRNA3CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170283429-A1 COMPOUNDS FOR THE TREATMENT OF PARAMYXOVIRUS VIRAL INFECTIONS Janssen Biopharma, Inc. 2017-10-05 US disclosed
US-20170283429-A1 COMPOUNDS FOR THE TREATMENT OF PARAMYXOVIRUS VIRAL INFECTIONS Janssen Biopharma, Inc. 2017-10-05 US disclosed
US-9724351-B2 Compounds for the treatment of paramoxyvirus viral infections ALIOS BIOPHARMA, INC. (US) 2017-08-08 US disclosed
US-9724351-B2 Compounds for the treatment of paramoxyvirus viral infections ALIOS BIOPHARMA, INC. (US) 2017-08-08 US disclosed
US-20150238498-A1 COMPOUNDS FOR THE TREATMENT OF PARAMOXYVIRUS VIRAL INFECTIONS JANSSEN PHARMACEUTICA NV (BE) 2015-08-27 US disclosed
US-20150238498-A1 COMPOUNDS FOR THE TREATMENT OF PARAMOXYVIRUS VIRAL INFECTIONS JANSSEN PHARMACEUTICA NV (BE) 2015-08-27 US disclosed
WO-2014031784-A1 COMPOUNDS FOR THE TREATMENT OF PARAMOXYVIRUS VIRAL INFECTIONS ALIOS BIOPHARMA, INC. (US) 2014-02-27 WO disclosed
CN-100516066-C Compounds for treating impaired fundic relaxation JANSSEN PHARMACEUTICA NV (BE) 2009-07-22 CN disclosed
US-7423048-B2 Compounds for treating fundic disaccomodation JANSSEN PHARMACEUTICA, N.V. (BE) 2008-09-09 US disclosed
EP-1636239-B1 INDOLE DERIVATIVES WITH AN IMPROVED ANTIPSYCHOTIC ACTIVITY JANSSEN PHARMACEUTICA NV (BE) 2007-07-18 EP disclosed
US-20060142318-A1 Compounds for treating fundic disaccomodation VAN EMELEN KRISTOF 2006-06-29 US disclosed
CN-1781921-A Compounds for treating impaired fundic relaxation JANSSEN PHARMACEUTICA NV (BE) 2006-06-07 CN disclosed
EP-1636239-A1 INDOLE DERIVATIVES WITH AN IMPROVED ANTIPSYCHOTIC ACTIVITY JANSSEN PHARMACEUTICA N.V. (BE) 2006-03-22 EP disclosed
EP-1296987-B1 COMPOUNDS FOR TREATING IMPAIRED FUNDIC RELAXATION JANSSEN PHARMACEUTICA NV (BE) 2005-12-07 EP disclosed
WO-2004106346-A1 INDOLE DERIVATIVES WITH AN IMPROVED ANTIPSYCHOTIC ACTIVITY JANSSEN PHARMACEUTICA N.V. (BE) 2004-12-09 WO disclosed
WO-2004106298-A1 INDOLE DERIVATIVES WITH AN IMPROVED ANTIPSYCHOTIC ACTIVITY JANSSEN PHARMACEUTICA N.V. (BE) 2004-12-09 WO disclosed
US-20040019051-A1 Compounds for treating impaired fundic relaxation JANSSEN-CILAG S.A. (ES) 2004-01-29 US disclosed
CN-1437602-A Compounds for treating impaired fundic relaxation JANSSEN PHARMACEUTICA NV (BE) 2003-08-20 CN disclosed
EP-1296987-A1 COMPOUNDS FOR TREATING IMPAIRED FUNDIC RELAXATION JANSSEN PHARMACEUTICA N.V. (BE) 2003-04-02 EP disclosed
WO-2001098306-A1 COMPOUNDS FOR TREATING IMPAIRED FUNDIC RELAXATION JANSSEN PHARMACEUTICA N.V. (BE) 2001-12-27 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 (4 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-20150238498-A1 COMPOUNDS FOR THE TREATMENT OF PARAMOXYVIRUS VIRAL INFECTIONS SARS1, MAVS, ZC3HAV1 PTGS1 1058/4885PTGS2 1434/4885GAA 863/4885
US-20170283429-A1 COMPOUNDS FOR THE TREATMENT OF PARAMYXOVIRUS VIRAL INFECTIONS MAVS, SARS1, ZC3HAV1 PTGS1 1527/4885PTGS2 1848/4885GAA 733/4885
US-20040019051-A1 Compounds for treating impaired fundic relaxation CNR2, CNR1, CBR1 PTGS1 119/4885PTGS2 391/4885GAA 2754/4885
US-20060142318-A1 Compounds for treating fundic disaccomodation ALK, ADORA1, CHRM2 PTGS1 1679/4885PTGS2 1813/4885GAA 2304/4885

“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.