SCHEMBL11943536

SCHEMBL11943536

CN1CCN(c2cnn(-c3ccc(F)cc3)c(=O)c2N2CCOCC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.50
RAB9A P51151 3/20 0.50
LMNA P02545 2/20 0.50
NPC1 O15118 2/20 0.50
POLB P06746 2/20 0.50
KMT2A Q03164 1/20 0.50
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
TP53 P04637 2/20 0.42
ALDH1A1 P00352 7/20 0.42
MAPK14 Q16539 1/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 1/20 0.41
GLA P06280 1/20 0.41
TSHR P16473 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
SCHEMBL13304476 0.88 SMN1; SMN2 (0.65) SMN1; SMN2RAB9ALMNANPC1POLB
SCHEMBL11943538 0.80 ALDH1A1 (0.62) SMN1; SMN2RAB9ALMNAPOLBKMT2A
SCHEMBL11943611 0.79 ALDH1A1 (0.51) SMN1; SMN2RAB9ALMNANPC1POLB
SCHEMBL11943535 0.78 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ALMNANPC1POLB
SCHEMBL13304485 0.74 NPC1 (0.65) SMN1; SMN2RAB9ALMNANPC1POLB
SCHEMBL11943623 0.73 POLB (0.46) SMN1; SMN2RAB9ALMNANPC1POLB
SCHEMBL11943166 0.71 NPC1 (0.51) SMN1; SMN2RAB9ALMNANPC1POLB
SCHEMBL11943187 0.70 MAPT (0.56) SMN1; SMN2RAB9ALMNANPC1POLB
SCHEMBL11943104 0.70 NPC1 (0.54) SMN1; SMN2RAB9ALMNANPC1POLB
SCHEMBL13219453 0.69 ALDH1A1 (0.59) SMN1; SMN2RAB9ALMNANPC1POLB

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 SMN1; SMN2 3911/4885RAB9A 4688/4885LMNA 929/4885

“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.