SCHEMBL2266566

SCHEMBL2266566

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 2/20 0.40
▸ MAPT P10636 5/20 0.36
▸ LMNA P02545 4/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ TRPV1 Q8NER1 3/20 0.36
▸ KARS1 Q15046 1/20 0.35
▸ KDR P35968 3/20 0.35
▸ EGFR P00533 2/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ NR4A1 P22736 1/20 0.34
▸ FLT1 P17948 1/20 0.34
▸ FLT4 P35916 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ROCK2 O75116 1/20 0.33

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
SCHEMBL2271101 0.98 PDE4B (0.41) PDE4BMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL2271739 0.84 PDE4B (0.61) PDE4B
SCHEMBL2270382 0.84 PDE4B (0.38) PDE4BLMNASMN1; SMN2TRPV1KARS1
SCHEMBL2270018 0.83 PDE4B (0.50) PDE4BMAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL2267799 0.82 PDE4B (0.49) PDE4BMAPTSMN1; SMN2TRPV1KARS1
SCHEMBL2271693 0.82 PDE4B (0.45) PDE4BMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL2272841 0.82 SHMT2 (0.39) PDE4BMAPTSMN1; SMN2TRPV1KARS1
SCHEMBL2269536 0.82 PDE4B (0.38) PDE4BLMNASMN1; SMN2TRPV1KARS1
SCHEMBL2273945 0.81 TRPV1 (0.46) TRPV1KARS1ROCK2
SCHEMBL2269760 0.81 TRPV1 (0.49) LMNAALDH1A1TRPV1KARS1KDM4E

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-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-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
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
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 PDE4B 1568/4885MAPT 4798/4885LMNA 4083/4885

“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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