SCHEMBL11946121

SCHEMBL11946121

CN1CCN(c2cnn(-c3cc(F)cc(F)c3)c(=O)c2Cl)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.51
DCTPP1 Q9H773 3/20 0.51
POLB P06746 3/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
PPARG P37231 1/20 0.51
NCOA2 Q15596 1/20 0.51
NCOA1 Q15788 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
NCOA3 Q9Y6Q9 1/20 0.51
MAPT P10636 3/20 0.50
SMN1; SMN2 Q16637 5/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
CA12 O43570 4/20 0.47
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
CA9 Q16790 4/20 0.47

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
SCHEMBL11943538 0.87 ALDH1A1 (0.62) ALDH1A1DCTPP1POLBCYP3A4CYP2C19
SCHEMBL11943534 0.82 ALDH1A1 (0.73) ALDH1A1DCTPP1POLBMAPTSMN1; SMN2
SCHEMBL13219453 0.82 ALDH1A1 (0.59) ALDH1A1DCTPP1POLBCYP3A4CYP2C19
SCHEMBL11943537 0.81 POLB (0.64) ALDH1A1DCTPP1POLBCYP3A4CYP2C19
SCHEMBL14899766 0.80 SMN1; SMN2 (0.45) ALDH1A1POLBCYP3A4CYP2C19PPARG
SCHEMBL14899732 0.78 BRD9 (0.45) ALDH1A1POLBCYP3A4CYP2C19PPARG
SCHEMBL14899749 0.77 SMN1; SMN2 (0.45) ALDH1A1POLBCYP3A4CYP2C19PPARG
SCHEMBL11946208 0.77 MAPT (0.56) ALDH1A1DCTPP1POLBCYP3A4CYP2C19
SCHEMBL14899771 0.76 SMN1; SMN2 (0.49) ALDH1A1DCTPP1POLBCYP3A4CYP2C19
SCHEMBL11943558 0.76 MAPT (0.66) ALDH1A1DCTPP1POLBCYP3A4CYP2C19

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 2 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-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 ALDH1A1 2437/4885DCTPP1 625/4885POLB 1088/4885

“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.