SCHEMBL626343

SCHEMBL626343

NC(=O)NCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.67
CYP2C9 P11712 1/20 0.65
CYP2C19 P33261 1/20 0.65
SMN1; SMN2 Q16637 2/20 0.59
ALDH1A1 P00352 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
HPGD P15428 1/20 0.56
LMNA P02545 3/20 0.55
TRPV1 Q8NER1 1/20 0.54
EPHX2 P34913 1/20 0.51
F2 P00734 1/20 0.51
F10 P00742 1/20 0.51
F7 P08709 1/20 0.51
POLB P06746 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50

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
SCHEMBL24575982 0.85 TSHR (0.71) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL30223375 0.84 CYP2C9 (0.64) TSHRCYP2C9CYP2C19SMN1; SMN2ALDH1A1
SCHEMBL12448898 0.84 CYP2C9 (0.59) TSHRCYP2C9CYP2C19SMN1; SMN2ALDH1A1
SCHEMBL31362165 0.83 TSHR (0.69) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL11305715 0.83 TSHR (0.69) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL3169688 0.83 TSHR (0.69) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL5653386 0.82 TSHR (0.63) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL5724113 0.81 TSHR (0.72) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL4019644 0.81 TSHR (0.57) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL30486705 0.81 TSHR (0.57) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729031-B2 Compounds NOVACTA BIOSYSTEMS LIMITED (GB) 2014-05-20 US claimed
EP-2393829-A1 ACTAGARDINE DERIVATIVES Novacta Biosystems Limited (GB) 2011-12-14 EP claimed
US-20110294723-A1 Compounds NOVACTA BIOSYSTEMS LIMITED (GB) 2011-12-01 US claimed
WO-2010089544-A1 ACTAGARDINE DERIVATIVES NOVACTA BIOSYSTEMS LIMITED (GB) 2010-08-12 WO claimed
US-9192569-B2 Formulations for infusion of type B lantibiotics NOVACTA BIOSYSTEMS LIMITED (GB) 2015-11-24 US disclosed
US-8729031-B2 Compounds NOVACTA BIOSYSTEMS LIMITED (GB) 2014-05-20 US disclosed
EP-2603204-A2 FORMULATIONS FOR INFUSION OF TYPE B LANTIBIOTICS Novacta Biosystems Limited (GB) 2013-06-19 EP disclosed
US-20130137630-A1 FORMULATIONS FOR INFUSION OF TYPE B LANTIBIOTICS NOVACTA BIOSYSTEMS LIMITED (GB) 2013-05-30 US disclosed
US-8293919-B2 Antibacterial sulfone and sulfoxide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-10-23 US disclosed
WO-2012020219-A2 FORMULATIONS FOR INFUSION OF TYPE B LANTIBIOTICS NOVACTA BIOSYSTEMS LIMITED (GB) 2012-02-16 WO disclosed
EP-2393829-A1 ACTAGARDINE DERIVATIVES Novacta Biosystems Limited (GB) 2011-12-14 EP disclosed
US-20110294723-A1 Compounds NOVACTA BIOSYSTEMS LIMITED (GB) 2011-12-01 US disclosed
WO-2010089544-A1 ACTAGARDINE DERIVATIVES NOVACTA BIOSYSTEMS LIMITED (GB) 2010-08-12 WO disclosed
WO-2006104983-A1 THERAPEUTIC METHODS FOR TYPE I DIABETES UNIVERSITY OF MASSACHUSETTS MEDICAL SCHOOL (US) 2006-10-05 WO disclosed
US-4405355-A HERBICIDES CHEVRON RESEARCH COMPANY (US) 1983-09-20 US disclosed
US-4273572-A HERBICIDES CHEVRON RESEARCH COMPANY (US) 1981-06-16 US disclosed
US-4200450-A HERBICIDES CHEVRON RESEARCH COMPANY (US) 1980-04-29 US disclosed
US-4111683-A HERBICIDE CHEVRON RESEARCH COMPANY (US) 1978-09-05 US disclosed
US-4012225-A Herbicidal 1-alkanoyloxy-haloethyl urea CHEVRON RESEARCH COMPANY (US) 1977-03-15 US disclosed
US-4007033-A Herbicidal substituted-haloethyl urea CHEVRON RESEARCH COMPANY (US) 1977-02-08 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 (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-20130137630-A1 FORMULATIONS FOR INFUSION OF TYPE B LANTIBIOTICS SLC5A2, SLC5A11, SPTSSB TSHR 2007/4885CYP2C9 4511/4885CYP2C19 4178/4885
US-20110294723-A1 Compounds SLC11A2, SDHA, SDHB TSHR 4345/4885CYP2C9 102/4885CYP2C19 66/4885

“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.