SCHEMBL12297633

SCHEMBL12297633

CC(C)C1=NN(c2nc3ccccc3s2)C(=O)C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.58
▸ POLB P06746 3/20 0.58
▸ MEN1 O00255 3/20 0.58
▸ GAA P10253 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ LMNA P02545 3/20 0.58
▸ CYP1A2 P05177 2/20 0.55
▸ CYP2D6 P10635 2/20 0.55
▸ CYP2C9 P11712 2/20 0.55
▸ AGER Q15109 1/20 0.49
▸ NPC1 O15118 7/20 0.45
▸ RAB9A P51151 7/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.45
▸ TSHR P16473 1/20 0.43
▸ KAT2A Q92830 1/20 0.43
▸ KAT2B Q92831 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ RECQL P46063 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
SCHEMBL186009 0.82 MEN1 (0.61) MAPTPOLBMEN1GAAKMT2A
SCHEMBL3529132 0.76 CYP1A2 (0.55) MAPTPOLBMEN1GAAKMT2A
SCHEMBL9541467 0.73 MAPT (0.60) MAPTPOLBMEN1GAAKMT2A
SCHEMBL9538451 0.73 MAPT (0.60) MAPTPOLBMEN1GAAKMT2A
SCHEMBL9379932 0.72 MEN1 (0.64) MAPTPOLBMEN1GAAKMT2A
SCHEMBL32690204 0.71 CYP1A2 (1.00) MAPTPOLBMEN1GAAKMT2A
SCHEMBL9537650 0.69 MAPT (0.54) MAPTPOLBMEN1GAAKMT2A
SCHEMBL9184204 0.65 NPC1 (0.54) MAPTPOLBMEN1GAAKMT2A
SCHEMBL14417581 0.65 RAB9A (0.65) MAPTPOLBMEN1GAAKMT2A
SCHEMBL4283622 0.65 MAPT (0.53) MAPTPOLBMEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10167263-B2 Treatment of amyotrophic lateral sclerosis NORTHWESTERN UNIVERSITY (US) 2019-01-01 — — US disclosed
US-20170349552-A1 Treatment of Amyotrophic Lateral Sclerosis NORTHWESTERN UNIVERSITY (US) 2017-12-07 — — US disclosed
US-9809556-B2 Treatment of amyotrophic lateral sclerosis NORTHWESTERN UNIVERSITY (US) 2017-11-07 — — US disclosed
US-20160016911-A1 Treatment of Amyotrophic Lateral Sclerosis NORTHWESTERN UNIVERSITY 2016-01-21 — — US disclosed
US-20160016911-A1 Treatment of Amyotrophic Lateral Sclerosis NORTHWESTERN UNIVERSITY 2016-01-21 — — US disclosed
US-9145424-B2 Treatment of amyotrophic lateral sclerosis NORTHWESTERN UNIVERSITY (US) 2015-09-29 — — US disclosed
US-9145424-B2 Treatment of amyotrophic lateral sclerosis NORTHWESTERN UNIVERSITY (US) 2015-09-29 — — US disclosed
US-20110237907-A1 TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS CAMBRIA PHARMACEUTICALS, INC. (US) 2011-09-29 — — US disclosed
US-20110237907-A1 TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS CAMBRIA PHARMACEUTICALS, INC. (US) 2011-09-29 — — 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 (3 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-20160016911-A1 Treatment of Amyotrophic Lateral Sclerosis SMN1; SMN2, SOD1, NLN MAPT 16/4885POLB 2415/4885MEN1 4639/4885
US-10167263-B2 Treatment of amyotrophic lateral sclerosis SMN1; SMN2, SOD1, NLN MAPT 16/4885POLB 2415/4885MEN1 4639/4885
US-20170349552-A1 Treatment of Amyotrophic Lateral Sclerosis SMN1; SMN2, SOD1, NLN MAPT 16/4885POLB 2415/4885MEN1 4639/4885

“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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