SCHEMBL13833704

SCHEMBL13833704

NC(=O)c1oc2ccccc2c1-c1nc2ccccc2s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.60
▸ RAB9A P51151 7/20 0.60
▸ NPC1 O15118 5/20 0.60
▸ KDM4E B2RXH2 5/20 0.60
▸ POLB P06746 4/20 0.60
▸ MEN1 O00255 4/20 0.60
▸ KMT2A Q03164 4/20 0.60
▸ APEX1 P27695 2/20 0.60
▸ TDP1 Q9NUW8 2/20 0.60
▸ HSD17B10 Q99714 2/20 0.60
▸ ESR1 P03372 1/20 0.60
▸ THRB P10828 2/20 0.53
▸ ALDH1A1 P00352 3/20 0.50
▸ HPGD P15428 2/20 0.50
▸ CTDSP1 Q9GZU7 1/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ CSNK2A2 P19784 1/20 0.46
▸ CSNK2B P67870 1/20 0.46
▸ CSNK2A1 P68400 1/20 0.46

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
SCHEMBL13833701 0.81 KDM4E (0.53) MAPTRAB9ANPC1KDM4EMEN1
SCHEMBL13833795 0.77 MAPT (0.55) MAPTRAB9ANPC1KDM4EPOLB
SCHEMBL13822671 0.77 MAPT (0.45) MAPTRAB9ANPC1KDM4EPOLB
SCHEMBL21682234 0.76 LIMK1 (0.53) MAPTRAB9ANPC1KDM4EPOLB
SCHEMBL28388321 0.75 KDM4E (0.49) MAPTRAB9ANPC1KDM4EPOLB
SCHEMBL6510910 0.75 PIK3CD (0.53) MAPTRAB9ANPC1KDM4EPOLB
SCHEMBL21681978 0.74 CNR1 (0.46) MAPTRAB9ANPC1KDM4EPOLB
SCHEMBL28218224 0.73 PIK3CD (0.47) MAPTRAB9ANPC1KDM4EPOLB
SCHEMBL21682123 0.72 MAP2 (0.55) MAPTRAB9ANPC1KDM4EPOLB
SCHEMBL20017373 0.70 MAPT (0.53) MAPTRAB9ANPC1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140303081-A1 APOPTOSIS-TARGETING NANOPARTICLES University of Georgia Foundation, Inc. (US) 2014-10-09 — — US disclosed
US-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. 2013-03-21 — — US disclosed
US-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. 2013-03-21 — — US disclosed
US-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. 2013-03-21 — — US disclosed
WO-2012154888-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. (US) 2012-11-15 — — WO 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-20140303081-A1 APOPTOSIS-TARGETING NANOPARTICLES AIFM1, BAX, BCL2 MAPT 627/4885RAB9A 1127/4885NPC1 489/4885
US-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS HSPA5, PSMG3, VCP MAPT 221/4885RAB9A 858/4885NPC1 809/4885

“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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