SCHEMBL3049569

SCHEMBL3049569

Cc1cccc(C(=O)N=C=S)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.52
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HPGD P15428 2/20 0.45
KCNK3 O14649 2/20 0.45
KCNK9 Q9NPC2 2/20 0.45
KCNH2 Q12809 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
POLB P06746 2/20 0.44
CTSL P07711 1/20 0.42
CTSK P43235 1/20 0.42
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
RAB9A P51151 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
ENPP3 O14638 1/20 0.41
ALPL P05186 1/20 0.41

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
SCHEMBL484004 0.87 L3MBTL1 (0.41) PARP1HDAC8HDAC6MEN1KMT2A
SCHEMBL4092403 0.84 PARP1 (0.53) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL5825205 0.81 TPMT (0.46) PARP1KMT2AHPGDPOLBNPC1
SCHEMBL3898425 0.79 HDAC8 (0.50) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL5824834 0.79 PARP1 (0.52) PARP1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL571813 0.79 CES2 (0.55) PARP1HDAC6SMN1; SMN2MEN1KMT2A
SCHEMBL3054202 0.79 PARP1 (0.52) PARP1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL5824521 0.78 CES2 (0.59) PARP1SMN1; SMN2MEN1KMT2AKCNK3
SCHEMBL10802915 0.77 PARP1 (0.59) PARP1HDAC8HDAC6SMN1; SMN2MEN1
SCHEMBL2892447 0.77 ALDH1A1 (0.48) HDAC6SMN1; SMN2MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059901-A 1,3, 4-Oxadiazole compound and preparation method and application thereof 成都大学 2026-05-19 CN disclosed
CN-118146109-A Method for synthesizing N-trifluoromethyl secondary amide compound from benzoyl isothiocyanate 南京理工大学 2024-06-07 CN disclosed
EP-2200977-B1 F1F0-ATPASE INHIBITORS AND RELATED METHODS UNIV MICHIGAN (US) 2016-11-09 EP disclosed
CN-102516144-B Thiourea compound and preparation thereof and application thereof to metal ore floatation UNIV CENTRAL SOUTH 2014-11-05 CN disclosed
CN-101855203-B F1F0Inhibitors of ATP synthase and related methods UNIV MICHIGAN 2014-03-19 CN disclosed
US-20130158111-A1 Compositions and Methods for Depleting Mutant p53 GEORGETOWN UNIVERSITY (US) 2013-06-20 US disclosed
US-8324258-B2 F1F0-ATPase inhibitors and related methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-12-04 US disclosed
CN-101855203-A F1F0Inhibitors of ATP synthase and related methods UNIV MICHIGAN 2010-10-06 CN disclosed
US-20100222400-A1 F1F0-ATPase Inhibitors and Related Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-09-02 US disclosed
EP-2200977-A2 F1F0-ATPASE INHIBITORS AND RELATED METHODS The Regents of the University of Michigan (US) 2010-06-30 EP disclosed
WO-2009036175-A2 F1F0-ATPASE INHIBITORS AND RELATED METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-03-19 WO disclosed
US-7135466-B2 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-14 US disclosed
US-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-21 US disclosed
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2004-07-08 US disclosed
EP-1243582-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES AND DRUGS CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2002-09-25 EP disclosed
US-6399773-B1 AUTOIMMUNE DISEASE; TRANSPLANTING ORGANS BRISTOL-MYERS SQUIBB CO. 2002-06-04 US disclosed
US-5084457-A Cognition activators and nervous system disorders AMERICAN CYANAMID COMPANY (US) 1992-01-28 US disclosed
US-5001157-A Substituted N-[[2-(aminocarbonyl)phenylamino]thioxomethyl]benzamides AMERICAN CYANAMID COMPANY (US) 1991-03-19 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 (3 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-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA PARP1 828/4885HDAC8 3866/4885HDAC6 2895/4885
US-20100222400-A1 F1F0-ATPase Inhibitors and Related Methods ATP5F1A, ATP5F1B, ATP5F1D PARP1 1171/4885HDAC8 2067/4885HDAC6 1788/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA PARP1 1112/4885HDAC8 2920/4885HDAC6 2414/4885

“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.