SCHEMBL633920

SCHEMBL633920

Nc1ccsc1C(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.59
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
CYP1A2 P05177 2/20 0.54
CYP2D6 P10635 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
CYP3A4 P08684 1/20 0.54
LMNA P02545 3/20 0.54
HTT P42858 2/20 0.54
KDR P35968 1/20 0.52
MAPT P10636 3/20 0.51
GAA P10253 2/20 0.51
ALDH1A1 P00352 1/20 0.51
AGTR1 P30556 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ADORA2A P29274 1/20 0.51
F10 P00742 2/20 0.51
NPC1 O15118 3/20 0.50

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
SCHEMBL1703373 0.84 NPC1 (0.56) RAB9AKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL1703428 0.83 DHODH (0.51) RAB9AKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL7532801 0.82 FADS1 (0.59) RAB9AKMT2AMEN1CYP1A2CYP2D6
SCHEMBL1496363 0.81 RAB9A (0.59) RAB9AKMT2AMEN1CYP1A2CYP2D6
SCHEMBL2186832 0.79 RAB9A (0.58) RAB9AKMT2AMEN1CYP1A2CYP2D6
SCHEMBL27497626 0.77 KMT2A (0.57) RAB9AKMT2AMEN1CYP1A2CYP2D6
SCHEMBL890859 0.77 GCK (0.48) RAB9AKMT2AMEN1CYP1A2CYP2C9
SCHEMBL632354 0.77 EPHX2 (0.55) RAB9AKMT2AMEN1SMN1; SMN2CYP3A4
SCHEMBL1703430 0.76 RXFP1 (0.44) RAB9AKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL2186838 0.76 MEN1 (0.63) RAB9AKMT2AMEN1CYP1A2CYP2D6

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
EP-1590328-B1 (2-CARBOXAMIDO) (3-AMINO) THIOPHENE COMPOUNDS OSI PHARM INC (US) 2012-02-22 EP disclosed
US-7696225-B2 (2-carboxamido)(3-Amino) thiophene compounds OSI PHARMACEUTICALS, INC. (US) 2010-04-13 US disclosed
US-7524859-B2 (2-carboxamido)(3-amino)thiophene compounds OSI PHARMACEUTICALS, INC. (US) 2009-04-28 US disclosed
EP-1590328-A4 (2-CARBOXAMIDO) (3-AMINO) THIOPHENE COMPOUNDS OSI PHARM INC (US) 2007-09-19 EP disclosed
EP-1807419-A1 (2-CARBOXAMIDO)(3-AMINO) THIOPHENE COMPOUNDS OSI Pharmaceuticals, Inc. (US) 2007-07-18 EP disclosed
US-20060247275-A1 (2-carboxamido)(3-amino)thiophene compounds CREW ANDREW P 2006-11-02 US disclosed
US-7101893-B2 (2-Carboxamido)(3-amino)thiophene compounds OSI PHARMACEUTICALS, INC. (US) 2006-09-05 US disclosed
WO-2006047574-A1 (2-CARBOXAMIDO)(3-AMINO) THIOPHENE COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2006-05-04 WO disclosed
EP-1590328-A2 (2-CARBOXAMIDO) (3-AMINO) THIOPHENE COMPOUNDS OSI Pharmaceuticals, Inc. (US) 2005-11-02 EP disclosed
US-6949563-B2 (2-carboxamido)(3-amino)thiophene compounds OSI PHARMACEUTICALS, INC. 2005-09-27 US disclosed
US-20050192320-A1 (2-Carboxamido)(3-amino)thiophene compounds CREW ANDREW P (US) 2005-09-01 US disclosed
US-20050154014-A1 (2-carboxamido)(3-amino) thiophene compounds OSI PHARMACEUTICALS, INC. 2005-07-14 US disclosed
US-20040186124-A1 (2-carboxamido)(3-amino)thiophene compounds OSI PHARMACEUTICALS, INC. 2004-09-23 US disclosed
WO-2004063330-A2 (2-CARBOXAMIDO) (3-AMINO) THIOPHENE COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2004-07-29 WO disclosed
WO-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 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-20040186124-A1 (2-carboxamido)(3-amino)thiophene compounds ABL1, NAT1, KRAS RAB9A 853/4885KMT2A 785/4885MEN1 892/4885
US-20050154014-A1 (2-carboxamido)(3-amino) thiophene compounds AADAC, PAM, TPMT RAB9A 1825/4885KMT2A 121/4885MEN1 1646/4885
US-20060247275-A1 (2-carboxamido)(3-amino)thiophene compounds PCNA, MKI67, MYC RAB9A 2855/4885KMT2A 1228/4885MEN1 1387/4885
US-20050192320-A1 (2-Carboxamido)(3-amino)thiophene compounds PCNA, MKI67, TPMT RAB9A 2384/4885KMT2A 827/4885MEN1 717/4885

“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.