SCHEMBL11943341

SCHEMBL11943341

O=c1c(OC2Cc3ccccc3C2)c(N2CCN(CCCc3ccccc3)CC2)cnn1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.48
▸ KMT2A Q03164 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ OPRM1 P35372 1/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HSD17B10 Q99714 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
SCHEMBL11943446 0.88 SIGMAR1 (0.46) SIGMAR1KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL11943353 0.85 SMN1; SMN2 (0.48) SIGMAR1KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL17058055 0.84 KMT2A (0.45) SIGMAR1KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL17057983 0.83 MAPT (0.46) SIGMAR1KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL11943397 0.81 BCL2L1 (0.48) KMT2ALMNAPOLBSMN1; SMN2NPC1
SCHEMBL11943368 0.81 ALDH1A1 (0.43) KMT2ALMNAPOLBSMN1; SMN2MEN1
SCHEMBL11943340 0.81 ALDH1A1 (0.42) KMT2ALMNAPOLBSMN1; SMN2NPC1
SCHEMBL11943344 0.81 SMN1; SMN2 (0.42) KMT2ALMNAPOLBSMN1; SMN2NPC1
SCHEMBL11943436 0.80 SIGMAR1 (0.43) SIGMAR1KMT2ALMNAPOLBSMN1; SMN2
SCHEMBL11943387 0.80 LMNA (0.43) SIGMAR1KMT2ALMNAPOLBSMN1; SMN2

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-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-20100158992-A1 PIPERAZINE-SUBSTITUTED PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS SCHERING CORPORATION (US) 2010-06-24 — — US disclosed
US-20100158992-A1 PIPERAZINE-SUBSTITUTED PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS SCHERING CORPORATION (US) 2010-06-24 — — 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 (2 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 SIGMAR1 4544/4885KMT2A 3312/4885LMNA 929/4885
US-20100158992-A1 PIPERAZINE-SUBSTITUTED PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS DPM1, GMPS, MAN2A1 SIGMAR1 4219/4885KMT2A 2126/4885LMNA 1760/4885

“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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