SCHEMBL1110123

SCHEMBL1110123

CC(=O)c1cc(CS)cc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 3/20 0.44
KDM4E B2RXH2 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
POLB P06746 3/20 0.41
NSD2 O96028 1/20 0.41
MCL1 Q07820 1/20 0.41
FOLH1 Q04609 3/20 0.41
MAOB P27338 2/20 0.40
AKR1B1 P15121 1/20 0.39
CYP1A2 P05177 3/20 0.38
CA12 O43570 1/20 0.38
NT5E P21589 1/20 0.38
CA9 Q16790 1/20 0.38
HSD17B10 Q99714 2/20 0.38
NR4A1 P22736 1/20 0.38
NR4A2 P43354 1/20 0.38
NR4A3 Q92570 1/20 0.38

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
SCHEMBL7670560 0.83 KDM4E (0.52) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL1110103 0.82 FOLH1 (0.43) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL6362640 0.75 CYP1A2 (0.53) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL10909445 0.75 CDC25B (0.60) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL25986589 0.75 MAPT (0.62) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL38665356 0.75 MAPT (0.62) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL50624 0.74 ALDH1A1 (0.56) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL19865344 0.74 CYP1A2 (0.41) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL13209727 0.74 CNR2 (0.49) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL13209718 0.74 ALDH1A1 (0.47) MAPTALDH1A1HPGDKDM4EMEN1

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
EP-2279291-B1 COFERONS AND METHODS OF MAKING AND USING THEM UNIV CORNELL (US) 2019-07-03 EP disclosed
US-9943603-B2 Coferons and methods of making and using them CORNELL UNIVERSITY (US) 2018-04-17 US disclosed
US-9943603-B2 Coferons and methods of making and using them CORNELL UNIVERSITY (US) 2018-04-17 US disclosed
US-20150105553-A1 COFERONS AND METHODS OF MAKING AND USING THEM NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-04-16 US disclosed
US-8853185-B2 Coferons and methods of making and using them CORNELL UNIVERSITY (US) 2014-10-07 US disclosed
US-20110263688-A1 COFERONS AND METHODS OF MAKING AND USING THEM PURDUE RESEARCH FOUNDATION (US) 2011-10-27 US disclosed
EP-2279291-A2 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2011-02-02 EP disclosed
WO-2009126290-A2 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2009-10-15 WO disclosed
WO-2009126290-A2 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2009-10-15 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-20150105553-A1 COFERONS AND METHODS OF MAKING AND USING THEM MYOF, TNFSF11, F13B MAPT 2555/4885ALDH1A1 2898/4885HPGD 2895/4885
US-20110263688-A1 COFERONS AND METHODS OF MAKING AND USING THEM MYOF, FTH1, TFRC MAPT 3431/4885ALDH1A1 3614/4885HPGD 1780/4885

“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.