SCHEMBL1921256

SCHEMBL1921256

C#Cc1cc(Cl)ccc1C(=O)O.c1cc2cc-2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DCLRE1B Q9H816 1/20 0.48
TSHR P16473 2/20 0.47
CASP1 P29466 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GRIK1 P39086 4/20 0.46
PTPN22 Q9Y2R2 1/20 0.44
SERPINE1 P05121 2/20 0.44
FABP3 P05413 1/20 0.44
FABP4 P15090 1/20 0.44
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ACMSD Q8TDX5 2/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
ACLY P53396 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL8576509 0.90 SMN1; SMN2 (0.57) TSHRCASP1SMN1; SMN2GRIK1ALDH1A1
SCHEMBL3213553 0.86 IKBKB (0.43) DCLRE1BCASP1GRIK1ALDH1A1MEN1
SCHEMBL4440190 0.83 KMO (0.51) DCLRE1BACMSDRXRARXRBHNF4A
SCHEMBL3208875 0.82 MEN1 (0.43) GRIK1SERPINE1ALDH1A1MEN1NPC1
SCHEMBL1927621 0.80 ACMSD (0.50) DCLRE1BTSHRPTPN22ALDH1A1ACMSD
SCHEMBL1095325 0.80 ACMSD (0.58) DCLRE1BPTPN22ACMSDACLYHNF4A
SCHEMBL5667262 0.79 ACMSD (0.46) DCLRE1BTSHRALDH1A1CA1CA2
Hydrochloric Acid SCHEMBL4352423 0.79 ACMSD (0.56) DCLRE1BPTPN22ACMSDACLYHNF4A
SCHEMBL4431134 0.78 ACMSD (0.44) TSHRPTPN22ALDH1A1ACMSDMEN1
SCHEMBL28787885 0.75 KDM4E (0.46) TSHRCASP1SMN1; SMN2ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283476-B2 Transition metal catalyzed synthesis of 2H-indazoles SANOFI (FR) 2012-10-09 US disclosed
EP-2170833-B1 A TRANSITION METAL CATALYZED SYNTHESIS OF 2H-INDAZOLES SANOFI AVENTIS (FR) 2011-06-01 EP disclosed
US-20100234601-A1 Transition metal catalyzed synthesis of 2H-indazoles SANOFI-AVENTIS (FR) 2010-09-16 US disclosed
EP-2170833-A1 A TRANSITION METAL CATALYZED SYNTHESIS OF 2H-INDAZOLES Sanofi-Aventis (FR) 2010-04-07 EP disclosed
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US disclosed
WO-2009000411-A1 A TRANSITION METAL CATALYZED SYNTHESIS OF 2H-INDAZOLES SANOFI-AVENTIS (FR) 2008-12-31 WO disclosed
US-20070004701-A1 Topoisomerase inhibitors PROPHARMACON, INC. (US) 2007-01-04 US disclosed
WO-2006022955-A2 TOPOISOMERASE INHIBITORS PROPHARMACON, INC. (US) 2006-03-02 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 (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-20100234601-A1 Transition metal catalyzed synthesis of 2H-indazoles H1-3, H1-2, H1-4 DCLRE1B 4798/4885TSHR 1297/4885CASP1 3759/4885
US-20070004701-A1 Topoisomerase inhibitors TOP1, TOP2A, TOP2B DCLRE1B 76/4885TSHR 4456/4885CASP1 1337/4885

“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.