SCHEMBL1144530

SCHEMBL1144530

O=c1[nH]ncc2cc(-c3ccc(Cl)cc3)sc12

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP1A1 P04798 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP1B1 Q16678 1/20 0.44
GRM1 Q13255 1/20 0.40
MCHR1 Q99705 7/20 0.40
NOTUM Q6P988 1/20 0.40
NOS1 P29475 2/20 0.39
DYRK1A Q13627 1/20 0.39
XDH P47989 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL3601787 0.82 NPC1 (0.54) RAB9AKDM4ESMN1; SMN2XDHALDH1A1
SCHEMBL3604808 0.82 METAP2 (0.43) RAB9ANOTUM
SCHEMBL386804 0.76 RAB9A (0.49) RAB9AKDM4ELMNASMN1; SMN2CYP1A1
SCHEMBL30334708 0.69 NOS1 (0.39) RAB9AKDM4ENOS1DYRK1AXDH
SCHEMBL4208111 0.68 RAB9A (0.74) RAB9AKDM4ELMNASMN1; SMN2MCHR1
SCHEMBL4806930 0.66 GRIN2D (0.41) KDM4ECYP1A2NOTUMXDHALDH1A1
SCHEMBL601322 0.66 NOS1 (0.56) LMNASMN1; SMN2NOS1DYRK1AALDH1A1
SCHEMBL4804927 0.66 MAPT (0.48) CYP1A2NOTUMALDH1A1KMT2A
SCHEMBL26427164 0.66 PARP1 (0.56) KDM4ESMN1; SMN2NOS1DYRK1AALDH1A1
SCHEMBL4049176 0.65 MAPT (0.47) RAB9AKDM4ECYP1A2NOTUMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142554-B1 NON-BASIC MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2015-01-14 EP disclosed
EP-2142554-B1 NON-BASIC MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2015-01-14 EP disclosed
US-7973159-B2 Non-basic melanin concentrating hormone receptor-1 antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2011-07-05 US disclosed
US-7973159-B2 Non-basic melanin concentrating hormone receptor-1 antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2011-07-05 US disclosed
US-7973159-B2 Non-basic melanin concentrating hormone receptor-1 antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2011-07-05 US disclosed
US-20110034375-A1 NON-BASIC MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY 2011-02-10 US disclosed
US-20110034375-A1 NON-BASIC MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY 2011-02-10 US disclosed
US-20110034375-A1 NON-BASIC MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY 2011-02-10 US disclosed
US-7851622-B2 Non-basic melanin concentrating hormone receptor-1 antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2010-12-14 US disclosed
US-7851622-B2 Non-basic melanin concentrating hormone receptor-1 antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2010-12-14 US disclosed
WO-2008134480-A1 NON-BASIC MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-06 WO disclosed
WO-2008134480-A1 NON-BASIC MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-06 WO disclosed
US-20080269110-A1 6-(4-Chlorophenyl)-3-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)-thieno[3,2-d][1,2,3]triazin-4(3H)-one, for example; for treating a patient suffering from an MCHR-1 modulated disease or disorder such as obesity, diabetes, depression or anxiety BRISTOL-MYERS SQUIBB COMPANY 2008-10-30 US disclosed
US-20080269110-A1 6-(4-Chlorophenyl)-3-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)-thieno[3,2-d][1,2,3]triazin-4(3H)-one, for example; for treating a patient suffering from an MCHR-1 modulated disease or disorder such as obesity, diabetes, depression or anxiety BRISTOL-MYERS SQUIBB COMPANY 2008-10-30 US disclosed
US-20080269110-A1 6-(4-Chlorophenyl)-3-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)-thieno[3,2-d][1,2,3]triazin-4(3H)-one, for example; for treating a patient suffering from an MCHR-1 modulated disease or disorder such as obesity, diabetes, depression or anxiety BRISTOL-MYERS SQUIBB COMPANY 2008-10-30 US disclosed
US-20080221107-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-09-11 US disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
WO-2008020799-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS ASTRAZENECA AB (SE) 2008-02-21 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-20080051405-A1 Therapeutic Agents GPR119, HTT, IAPP RAB9A 1071/4885KDM4E 2988/4885LMNA 4188/4885
US-20110034375-A1 NON-BASIC MELANIN CONCENTRATING HORMONE RECEPTOR-1 ANTAGONISTS MCHR1, MCHR2, MC1R RAB9A 1642/4885KDM4E 2534/4885LMNA 2714/4885
US-20080269110-A1 6-(4-Chlorophenyl)-3-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)-thieno[3,2-d][1,2,3]triazin-4(3H)-one, for example; for treating a patient suffering from an MCHR-1 modulated disease or disorder such as obesity, diabetes, depression or anxiety MCHR1, MCHR2, MC3R RAB9A 2751/4885KDM4E 1904/4885LMNA 2492/4885
US-20080221107-A1 Therapeutic Agents HTT, ACHE, GRIN2A RAB9A 822/4885KDM4E 2711/4885LMNA 3656/4885

“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.