SCHEMBL2265504

SCHEMBL2265504

O=C(O)C1(c2ccc(Nc3nc4c(c(N5CCOCC5)n3)CCC4)cc2)CCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.47
▸ LRRK2 Q5S007 1/20 0.44
▸ LMNA P02545 6/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ HTT P42858 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ TSHR P16473 2/20 0.40
▸ MTOR P42345 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MERTK Q12866 1/20 0.39
▸ PIK3R1 P27986 1/20 0.39
▸ PIK3CA P42336 1/20 0.39
▸ CHEK1 O14757 1/20 0.38
▸ MEN1 O00255 1/20 0.38

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
SCHEMBL2268349 0.91 ACHE (0.44) ACHELRRK2LMNAALDH1A1HTT
SCHEMBL2268360 0.83 TRPV1 (0.46) ACHELMNAALDH1A1KDM4EHPGD
SCHEMBL2268981 0.81 TRPV1 (0.46) ACHELMNAALDH1A1KDM4EHPGD
SCHEMBL2268361 0.81 TRPV1 (0.46) ACHELMNAALDH1A1KDM4EHPGD
SCHEMBL2269303 0.75 BRD4 (0.39) ACHEALDH1A1TSHRMEN1KMT2A
SCHEMBL3230006 0.75 CARM1 (0.41) LRRK2LMNAALDH1A1HTTKDM4E
SCHEMBL2268242 0.74 MERTK (0.45) MERTKMEN1KMT2A
SCHEMBL2268972 0.74 AXL (0.42) LMNAALDH1A1HTTKDM4EALOX15
SCHEMBL2266722 0.74 IGF1R (0.45) ACHE
SCHEMBL2267297 0.74 TRPV1 (0.44) ACHELMNAALDH1A1KDM4EHPGD

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-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-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

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 ACHE 4830/4885LRRK2 4218/4885LMNA 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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