SCHEMBL11946281

SCHEMBL11946281

CC1(COc2c(N3CCN(S(=O)(=O)Cc4ccc5c(c4)NC(=O)CO5)CC3)cnn(-c3cc(F)cc(F)c3)c2=O)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 7/20 0.40
▸ HTR1D P28221 6/20 0.40
▸ HTR1B P28222 5/20 0.40
▸ SLC6A4 P31645 5/20 0.40
▸ POLB P06746 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ DRD2 P14416 5/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ DRD4 P21917 4/20 0.38
▸ DRD3 P35462 3/20 0.38
▸ NR3C2 P08235 4/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL11946282 0.90 MMP13 (0.35) HTR1AHTR1DHTR1BSLC6A4POLB
SCHEMBL17057858 0.86 MAPT (0.33) POLB
SCHEMBL11945729 0.85 PIK3CA (0.36) POLB
SCHEMBL11945630 0.85 MAPT (0.37) POLBKMT2AMEN1
SCHEMBL11944396 0.85 MAPT (0.38) POLBKMT2AMEN1
SCHEMBL11946195 0.85 MAPT (0.38) POLB
SCHEMBL11946496 0.85 MAPT (0.36) POLB
SCHEMBL11945290 0.85 MAPT (0.38) POLBKMT2A
SCHEMBL11945453 0.84 MAPT (0.45) POLBGAAKMT2A
SCHEMBL11946252 0.84 MAPT (0.37) POLB

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-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 — — US disclosed
US-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 — — US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 — — US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 — — 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-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors MAN2A1, GYS2, MANBA HTR1A 4010/4885HTR1D 4160/4885HTR1B 4053/4885

“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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