SCHEMBL2268284

SCHEMBL2268284

COC(=O)C1(c2ccc(Nc3nc(N4CCCC4=O)nc4c3CCC4)cc2)CCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KARS1 Q15046 1/20 0.42
▸ TRPV1 Q8NER1 8/20 0.38
▸ HTR2A P28223 2/20 0.37
▸ HTR2C P28335 2/20 0.37
▸ LMNA P02545 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ NR4A1 P22736 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ PDE4B Q07343 2/20 0.36
▸ IGF1R P08069 5/20 0.35
▸ FLT1 P17948 1/20 0.34
▸ FLT4 P35916 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ FLT3 P36888 1/20 0.34

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
SCHEMBL12392997 0.90 PDE4B (0.39) KARS1TRPV1HTR2AHTR2CPDE4B
SCHEMBL2269760 0.84 TRPV1 (0.49) KARS1TRPV1HTR2AHTR2CLMNA
SCHEMBL2273945 0.84 TRPV1 (0.46) KARS1TRPV1HTR2AHTR2CIGF1R
SCHEMBL2267786 0.83 TRPV1 (0.49) KARS1TRPV1HTR2AHTR2C
SCHEMBL2267049 0.83 TRPV1 (0.49) TRPV1HTR2AHTR2CLMNA
SCHEMBL2266566 0.81 PDE4B (0.40) KARS1TRPV1LMNATSHRNR4A1
SCHEMBL2271101 0.79 PDE4B (0.41) KARS1TRPV1LMNASMN1; SMN2PDE4B
SCHEMBL2266722 0.78 IGF1R (0.45) KARS1TRPV1HTR2AHTR2CPDE4B
SCHEMBL2270382 0.77 PDE4B (0.38) KARS1TRPV1HTR2AHTR2CLMNA
SCHEMBL2271739 0.77 PDE4B (0.61) PDE4BIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989463-B2 Biccyclic compounds as GATA modulators DR. REDDY'S LABORATORIES LIMITED (IN) 2011-08-02 — — US claimed
US-20100144731-A1 Novel Biccyclic Compounds As GATA Modulators DR. REDDY'S LABORATORIES LTD. (IN) 2010-06-10 — — US claimed
US-7989463-B2 Biccyclic compounds as GATA modulators DR. REDDY'S LABORATORIES LIMITED (IN) 2011-08-02 — — US disclosed
US-7989463-B2 Biccyclic compounds as GATA modulators DR. REDDY'S LABORATORIES LIMITED (IN) 2011-08-02 — — US disclosed
US-20100144731-A1 Novel Biccyclic Compounds As GATA Modulators DR. REDDY'S LABORATORIES LTD. (IN) 2010-06-10 — — US disclosed
US-20100144731-A1 Novel Biccyclic Compounds As GATA Modulators DR. REDDY'S LABORATORIES LTD. (IN) 2010-06-10 — — US disclosed
WO-2010028174-A1 NOVEL BICCYCLIC COMPOUNDS AS GATA MODULATORS DR. REDDY'S LABORATORIES LTD. (IN) 2010-03-11 — — 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 (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-20100144731-A1 Novel Biccyclic Compounds As GATA Modulators GATAD2A, GATAD2B, RUNX1 KARS1 2108/4885TRPV1 3823/4885HTR2A 2277/4885

“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.

Send feedback