SCHEMBL7658670

SCHEMBL7658670

Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2O)c(Br)s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 3/20 0.60
KMT2A Q03164 7/20 0.57
MEN1 O00255 5/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
GAA P10253 2/20 0.57
PABPC1 P11940 1/20 0.55
DUSP3 P51452 1/20 0.55
PTPN5 P54829 1/20 0.55
PTPN11 Q06124 1/20 0.55
EIF4H Q15056 1/20 0.55
CTDSP1 Q9GZU7 1/20 0.55
RAB9A P51151 3/20 0.54
NPC1 O15118 2/20 0.54
POLB P06746 1/20 0.52
CXCR1 P25024 1/20 0.51
CXCR2 P25025 1/20 0.51
PDPK1 O15530 2/20 0.50
AKT1 P31749 2/20 0.50
CYTH3 O43739 1/20 0.50
MAPT P10636 5/20 0.49

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
SCHEMBL7660313 0.91 KCNMA1 (0.60) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL6991334 0.82 KCNMA1 (0.57) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL6998631 0.80 KCNMA1 (0.61) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL6996991 0.80 KCNMA1 (0.52) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL6997403 0.78 NPC1 (0.55) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL6995125 0.75 RAB9A (0.53) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL1024222 0.74 CXCR2 (0.68) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL1024223 0.74 CXCR2 (0.68) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL11874002 0.74 CXCR1 (0.68) KCNMA1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL915213 0.73 MEN1 (0.64) KCNMA1KMT2AMEN1SMN1; SMN2GAA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6455521-B1 PSYCHOLOGICAL DISORDERS; SIDE EFFECT REDUCTION MITSUBISHI PHARMA CORPORATION (JP) 2002-09-24 US disclosed
US-20020042411-A1 Condensed thiophene compounds and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2002-04-11 US disclosed
US-6271225-B1 PSYCHOLOGICAL DISORDERS WELFIDE CORPORATION (JP) 2001-08-07 US disclosed
CN-1268949-A Fused thiophene compounds and medical use thereof YOSHITOMI PHARMACEUTICAL (JP) 2000-10-04 CN disclosed
EP-1016664-A1 FUSED THIOPHENE COMPOUNDS AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2000-07-05 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 (1 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-20020042411-A1 Condensed thiophene compounds and pharmaceutical use thereof ACIN1, ACHE, TPMT KCNMA1 2043/4885KMT2A 2923/4885MEN1 1756/4885

“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.