SCHEMBL2400629

SCHEMBL2400629

O=C(NCc1cccs1)c1ccc(Cl)cc1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.74
RAB9A P51151 4/20 0.74
NPC1 O15118 2/20 0.74
TAAR1 Q96RJ0 1/20 0.74
THRB P10828 1/20 0.66
ALDH1A1 P00352 3/20 0.65
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
CXCR3 P49682 1/20 0.64
PKM P14618 1/20 0.61
TSHR P16473 1/20 0.61
HTT P42858 2/20 0.59
USP2 O75604 1/20 0.59
POLB P06746 2/20 0.57
LMNA P02545 2/20 0.57
KDM4E B2RXH2 1/20 0.57
MAPT P10636 1/20 0.57

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
SCHEMBL5334839 0.86 HPGD (0.68) HPGDRAB9ANPC1TAAR1THRB
SCHEMBL2234130 0.85 HPGD (1.00) HPGDRAB9ANPC1THRBALDH1A1
SCHEMBL10441846 0.85 RAB9A (1.00) HPGDRAB9ANPC1TAAR1ALDH1A1
SCHEMBL5551614 0.84 HPGD (0.74) HPGDRAB9ATHRBALDH1A1MEN1
SCHEMBL2305026 0.84 HPGD (0.74) HPGDRAB9ATHRBALDH1A1MEN1
SCHEMBL13947125 0.84 HPGD (0.74) HPGDRAB9ANPC1THRBALDH1A1
Hydrochloric Acid SCHEMBL28152221 0.84 HPGD (0.97) HPGDRAB9ANPC1THRBALDH1A1
SCHEMBL9729421 0.84 HPGD (0.70) HPGDRAB9ANPC1TAAR1THRB
SCHEMBL14484111 0.83 HPGD (0.82) HPGDRAB9ANPC1THRBALDH1A1
SCHEMBL13762085 0.82 HPGD (0.70) HPGDRAB9ATHRBALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1592389-B1 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES SERONO LAB (CH) 2009-04-22 EP claimed
US-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 US claimed
EP-1322642-B1 Pharmaceutically active sulfonamide derivatives bearing both lipophilic and ionisable moieties as inhibitors of Protein Jun-kinases MERCK SERONO SA (CH) 2013-09-04 EP disclosed
US-8017628-B2 Pharmaceutically active sulfonyl hydrazide derivatives MERCK SERONO S.A. (CH) 2011-09-13 US disclosed
US-8012995-B1 Pharmaceutically active sulfonamide derivatives MERCK SERONO SA (CH) 2011-09-06 US disclosed
US-7683078-B2 Arylsulfonamide derivatives as C-Jun-N-Terminal Kinases (JNK's) inhibitors LABORATOIRES SERONO S.A. (CH) 2010-03-23 US disclosed
US-7683078-B2 Arylsulfonamide derivatives as C-Jun-N-Terminal Kinases (JNK's) inhibitors LABORATOIRES SERONO S.A. (CH) 2010-03-23 US disclosed
US-7683078-B2 Arylsulfonamide derivatives as C-Jun-N-Terminal Kinases (JNK's) inhibitors LABORATOIRES SERONO S.A. (CH) 2010-03-23 US disclosed
US-20100029719-A1 ARYLSULFONAMIDE DERIVATIVES AS C-JUN-N-TERMINAL KINASES (JNK'S) INHIBITORS LABORATOIRES SERONO S.A. (CH) 2010-02-04 US disclosed
US-20100029719-A1 ARYLSULFONAMIDE DERIVATIVES AS C-JUN-N-TERMINAL KINASES (JNK'S) INHIBITORS LABORATOIRES SERONO S.A. (CH) 2010-02-04 US disclosed
US-20100029719-A1 ARYLSULFONAMIDE DERIVATIVES AS C-JUN-N-TERMINAL KINASES (JNK'S) INHIBITORS LABORATOIRES SERONO S.A. (CH) 2010-02-04 US disclosed
EP-1218375-A1 PHARMACEUTICALLY ACTIVE SULFONYL AMINO ACID DERIVATIVES Applied Research Systems ARS Holding N.V. (AN) 2002-07-03 EP disclosed
EP-1216245-A1 PHARMACEUTICALLY ACTIVE SULFONYL HYDRAZIDE DERIVATIVES Applied Research Systems ARS Holding N.V. (AN) 2002-06-26 EP disclosed
WO-2002026733-A2 sHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES BEARING BOTH LIPOPHILIC AND IONISABLE MOIETIES AS INHIBITORS OF PROTEIN JUNKINASES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2002-04-04 WO disclosed
EP-1193268-A1 Pharmaceutically active sulfonamide derivatives bearing both lipophilic and ionisable moieties as inhibitors of protein Junkinases Applied Research Systems ARS Holding N.V. (AN) 2002-04-03 EP disclosed
WO-2001023378-A1 PHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-04-05 WO disclosed
WO-2001023379-A1 PHARMACEUTICALLY ACTIVE SULFONYL AMINO ACID DERIVATIVES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-04-05 WO disclosed
WO-2001023382-A1 PHARMACEUTICALLY ACTIVE SULFONYL HYDRAZIDE DERIVATIVES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-04-05 WO disclosed
EP-1088822-A1 Pharmaceutically active sulfonyl hydrazide derivatives Applied Research Systems ARS Holding N.V. (AN) 2001-04-04 EP disclosed
EP-1088815-A1 Pharmaceutically active sulfonyl amino acid derivatives Applied Research Systems ARS Holding N.V. (AN) 2001-04-04 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 (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-20100029719-A1 ARYLSULFONAMIDE DERIVATIVES AS C-JUN-N-TERMINAL KINASES (JNK'S) INHIBITORS MAPK1, MAPK3, MAP3K2 HPGD 3458/4885RAB9A 2631/4885NPC1 3653/4885
US-20070142391-A1 Piperazine-2-carboxamide derivatives P2RX5, P2RX2, NPY5R HPGD 745/4885RAB9A 4023/4885NPC1 4763/4885

“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.