SCHEMBL2267024

SCHEMBL2267024

Clc1nc2c(c(Oc3ccccc3)n1)CCC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 16/20 0.51
▸ BCHE P06276 15/20 0.51
▸ PIN1 Q13526 2/20 0.47
▸ C5AR1 P21730 1/20 0.42
▸ SLC2A1 P11166 1/20 0.41
▸ GRIN1 Q05586 2/20 0.41
▸ GRIN2A Q12879 2/20 0.41
▸ GRIN2B Q13224 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ CACNB4 O00305 1/20 0.41
▸ CACNA1A O00555 1/20 0.41
▸ SLC22A2 O15244 1/20 0.41
▸ SLC22A1 O15245 1/20 0.41
▸ ABCC4 O15439 1/20 0.41
▸ CACNA1G O43497 1/20 0.41
▸ CACNG3 O60359 1/20 0.41
▸ CACNA1F O60840 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
SCHEMBL18833257 0.83 BCHE (0.47) ACHEBCHESLC2A1ALDH1A1KDM4E
SCHEMBL24287389 0.81 LMNA (0.57) ACHEBCHEALDH1A1TSHRHSD17B10
SCHEMBL18833248 0.78 SMN1; SMN2 (0.46) ACHEBCHESLC2A1APPTHRB
SCHEMBL24287266 0.77 LMNA (0.57) ACHEBCHEGRIN1GRIN2AGRIN2B
SCHEMBL26813080 0.77 ACHE (0.45) ACHEBCHEGRIN1GRIN2AGRIN2B
SCHEMBL17290143 0.77 ALDH1A1 (0.52) ACHEBCHEALDH1A1TSHRHSD17B10
SCHEMBL15920942 0.74 LMNA (0.47) ACHEBCHEALDH1A1APPLMNA
SCHEMBL26815019 0.74 BCHE (0.45) ACHEBCHEGRIN1GRIN2AGRIN2B
SCHEMBL26813092 0.74 BCHE (0.45) ACHEBCHEGRIN1GRIN2AGRIN2B
SCHEMBL15921295 0.74 ALDH1A1 (0.52) ACHEBCHEALDH1A1TSHRKDM4E

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 6 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

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 4830/4885BCHE 3426/4885PIN1 3812/4885

“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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