SCHEMBL6311471

SCHEMBL6311471

O=C(O)C(=O)Nc1scc(-c2ccccc2)c1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 13/20 0.64
▸ MEN1 O00255 12/20 0.64
▸ RAB9A P51151 4/20 0.63
▸ NPC1 O15118 4/20 0.63
▸ SMN1; SMN2 Q16637 3/20 0.63
▸ MAPT P10636 2/20 0.63
▸ LMNA P02545 1/20 0.63
▸ SLC12A2 P55011 1/20 0.63
▸ SLC12A5 Q9H2X9 1/20 0.63
▸ NLRP3 Q96P20 1/20 0.63
▸ PKM P14618 3/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ USP2 O75604 1/20 0.61
▸ TP53 P04637 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ HTT P42858 1/20 0.61
▸ HSD17B10 Q99714 1/20 0.61
▸ GRIN2C Q14957 1/20 0.60
▸ TDP1 Q9NUW8 2/20 0.57
▸ KDM4E B2RXH2 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
SCHEMBL27558688 0.84 KMT2A (0.61) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL21247164 0.83 MEN1 (0.82) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL10481226 0.82 KMT2A (0.65) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL27558689 0.81 GSTO1 (0.63) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL21259064 0.81 KMT2A (0.63) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL24480003 0.81 KMT2A (0.60) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL1797300 0.80 KMT2A (0.59) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL1799720 0.80 KMT2A (0.61) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL10481224 0.79 KMT2A (0.61) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL21259065 0.77 MEN1 (0.73) KMT2AMEN1RAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050119332-A1 Substituted thiophene compounds as modulators of protein tyrosine phosphatases (PTPases) JEPPESEN LONE (DK) 2005-06-02 — — US claimed
US-20020165398-A1 Modulators of protein tyrosine phosphatases (PTPases) JEPPESEN LONE (DK) 2002-11-07 — — US claimed
US-20020002199-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2002-01-03 — — US claimed
EP-1062204-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2000-12-27 — — EP claimed
WO-1999046244-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 1999-09-16 — — WO claimed
US-20050119332-A1 Substituted thiophene compounds as modulators of protein tyrosine phosphatases (PTPases) JEPPESEN LONE (DK) 2005-06-02 — — US disclosed
US-20020165398-A1 Modulators of protein tyrosine phosphatases (PTPases) JEPPESEN LONE (DK) 2002-11-07 — — US disclosed
US-20020002199-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2002-01-03 — — US disclosed
EP-1062204-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2000-12-27 — — EP disclosed
WO-1999046244-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 1999-09-16 — — 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 (3 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-20020165398-A1 Modulators of protein tyrosine phosphatases (PTPases) PTPRCAP, PTPRS, PTPRO KMT2A 3317/4885MEN1 3299/4885RAB9A 2766/4885
US-20020002199-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) PTPRCAP, PTPRS, PTPRA KMT2A 3329/4885MEN1 3307/4885RAB9A 2751/4885
US-20050119332-A1 Substituted thiophene compounds as modulators of protein tyrosine phosphatases (PTPases) PTPRCAP, PTPRS, PTPN1 KMT2A 3051/4885MEN1 4004/4885RAB9A 2114/4885

“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.

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