SCHEMBL839601

SCHEMBL839601

Cc1ccc(C)c(-n2ncc3c(Cl)ncnc32)c1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.55
TP53 P04637 11/20 0.55
LMNA P02545 9/20 0.54
HPGD P15428 3/20 0.52
HTT P42858 2/20 0.52
ALDH1A1 P00352 1/20 0.52
KDM4E B2RXH2 2/20 0.51
PIP4K2A P48426 1/20 0.51
NPC1 O15118 1/20 0.51
PKM P14618 1/20 0.51
MAPT P10636 6/20 0.50
POLB P06746 1/20 0.48
ALOX15 P16050 1/20 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
SCHEMBL838540 0.86 TP53 (0.57) RAB9ATP53LMNAHTTPIP4K2A
SCHEMBL12414250 0.84 RAB9A (0.53) RAB9ATP53LMNAHPGDHTT
SCHEMBL838153 0.83 RAB9A (0.55) RAB9ATP53LMNAHPGDHTT
SCHEMBL840215 0.83 TP53 (0.50) TP53LMNAPIP4K2AMAPTPOLB
SCHEMBL850577 0.83 TP53 (0.50) RAB9ATP53LMNAPIP4K2AMAPT
SCHEMBL839657 0.83 SLC2A1 (0.54) RAB9ATP53LMNAHPGDHTT
SCHEMBL838694 0.81 CYP17A1 (0.46) RAB9ATP53LMNAMAPTPOLB
SCHEMBL6269930 0.80 XDH (0.68) RAB9ATP53LMNAHPGDALDH1A1
SCHEMBL25342411 0.78 HTT (0.54) RAB9ATP53LMNAHPGDHTT
SCHEMBL840324 0.78 NPC1 (0.71) RAB9ATP53LMNAHPGDHTT

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-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
EP-2324028-A2 THERAPEUTIC AGENTS 414 AstraZeneca AB (SE) 2011-05-25 EP disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
WO-2010015849-A2 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-02-11 WO disclosed
WO-2010015849-A2 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-02-11 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 (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-20100093757-A1 THERAPEUTIC AGENTS 414 GCK, GCKR, GPR119 RAB9A 3239/4885TP53 4297/4885LMNA 3530/4885

“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.