SCHEMBL4924879

SCHEMBL4924879

Nc1c2c(nc3c(-c4cnccn4)cccc13)CN(C1CCC1)C2=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.35
▸ MAPK10 P53779 1/20 0.35
▸ ACVR1 Q04771 5/20 0.34
▸ BMPR1A P36894 4/20 0.34
▸ ACVRL1 P37023 4/20 0.34
▸ PARP1 P09874 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ GRM5 P41594 3/20 0.33
▸ GRM1 Q13255 1/20 0.33
▸ CDK5 Q00535 1/20 0.32
▸ CDK5R1 Q15078 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ PARP2 Q9UGN5 1/20 0.32
▸ OPRL1 P41146 2/20 0.31
▸ OGFRL1 Q5TC84 2/20 0.31
▸ CDK4 P11802 1/20 0.31

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
SCHEMBL2669394 0.88 GRM5 (0.36) ACVR1BMPR1AACVRL1PARP1POLB
SCHEMBL2669510 0.85 ACVR1 (0.34) TSHRMAPK10ACVR1BMPR1AACVRL1
SCHEMBL2656099 0.85 PARP1 (0.35) TSHRMAPK10ACVR1BMPR1AACVRL1
SCHEMBL2669534 0.85 LCK (0.46) TSHRMAPK10ACVR1BMPR1AACVRL1
SCHEMBL2669396 0.84 PARP1 (0.35) TSHRMAPK10ACVR1BMPR1AACVRL1
SCHEMBL2669509 0.84 ACVR1 (0.40) ACVR1BMPR1AACVRL1PARP1POLB
SCHEMBL2669539 0.83 MAPK1 (0.36) TSHRMAPK10ACVR1BMPR1AACVRL1
SCHEMBL4921275 0.82 GABRG2 (0.43) TSHRMAPK10POLB
SCHEMBL2669424 0.82 MAPK1 (0.36) TSHRMAPK10ACVR1BMPR1AACVRL1
SCHEMBL2661202 0.82 TSHR (0.35) TSHRMAPK10ACVR1BMPR1AACVRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US claimed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US disclosed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US disclosed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — 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-20080318943-A1 Compounds and Uses Thereof - 848 COMT, BACE1, BDNF TSHR 265/4885MAPK10 4168/4885ACVR1 4057/4885

“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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