SCHEMBL8634063

SCHEMBL8634063

Cc1ncsc1C(O)c1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 8/20 0.38
BRD4 O60885 2/20 0.37
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
CREBBP Q92793 1/20 0.36
HPGD P15428 1/20 0.34
ALDH1A1 P00352 1/20 0.34
AOC3 Q16853 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL9025375 0.89 ALDH1A1 (0.42) FFAR2BRD4MEN1LMNAKMT2A
SCHEMBL9026742 0.83 ATM (0.38) BRD4KMT2ACREBBPAOC3KDM4E
SCHEMBL2593085 0.83 SLC6A3 (0.44) BRD4LMNACREBBPHPGDALDH1A1
SCHEMBL8631273 0.83 BRD4 (0.41) BRD4LMNAALDH1A1
SCHEMBL8631276 0.81 BRD4 (0.41) BRD4MEN1KMT2ACREBBP
SCHEMBL8633179 0.81 CYP3A4 (0.40) BRD4MEN1LMNAKMT2AALDH1A1
SCHEMBL8683323 0.80 KDM4E (0.43) MEN1LMNAKMT2AALDH1A1KDM4E
SCHEMBL8633346 0.78 LMNA (0.40) MEN1LMNAKMT2A
SCHEMBL15615745 0.78 SLC6A2 (0.40) MEN1LMNAKMT2AALDH1A1KDM4E
SCHEMBL8632721 0.74 ALOX5 (0.33) KDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957086-B2 Compounds and methods of treating brain disorders THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2015-02-17 US disclosed
US-8957086-B2 Compounds and methods of treating brain disorders THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2015-02-17 US disclosed
WO-2014013338-A2 COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE SGC PHARMA, INC. (CA) 2014-01-23 WO disclosed
US-20130131099-A1 COMPOUNDS AND METHODS OF TREATING BRAIN DISORDERS THATCHER GREGORY R J (US) 2013-05-23 US disclosed
US-20130131099-A1 COMPOUNDS AND METHODS OF TREATING BRAIN DISORDERS THATCHER GREGORY R J (US) 2013-05-23 US disclosed
WO-2011140198-A2 COMPOUNDS AND METHODS OF TREATING BRAIN DISORDERS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2011-11-10 WO disclosed
US-5712299-A TREATMENT OF NEURODEGENERATIVE DISORDERS ASTRA AKTIEBOLAG (SE) 1998-01-27 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-20130131099-A1 COMPOUNDS AND METHODS OF TREATING BRAIN DISORDERS NLN, PYGB, OTC FFAR2 2626/4885BRD4 4418/4885MEN1 3365/4885

“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.