SCHEMBL754990

SCHEMBL754990

CS(=O)(=O)NCCC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.51
CA1 P00915 6/20 0.51
CA2 P00918 6/20 0.51
CA9 Q16790 6/20 0.51
KMT2A Q03164 4/20 0.50
MAPT P10636 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MAPK1 P28482 2/20 0.50
MEN1 O00255 2/20 0.50
LMNA P02545 1/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP3A4 P08684 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
CES1 P23141 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SIGMAR1 Q99720 1/20 0.50
HSD11B1 P28845 1/20 0.50
POLB P06746 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
SCHEMBL27704055 0.90 TDP1 (0.56) CA12CA1CA2CA9KMT2A
SCHEMBL754844 0.83 KMT2A (0.56) KMT2AMAPTTDP1MAPK1MEN1
SCHEMBL20490967 0.83 NPC1 (0.55) CA12CA2CA9KMT2AMEN1
SCHEMBL4126030 0.82 CA12 (0.51) CA12CA1CA2CA9KMT2A
SCHEMBL27647313 0.81 ALDH1A1 (0.55) CA12CA1CA2CA9KMT2A
SCHEMBL13670592 0.80 HDAC1 (0.57) MAPTTDP1L3MBTL1LMNAKDM4E
Thiosemicarbazide SCHEMBL27703889 0.80 POLB (0.46) CA12CA1CA2CA9MAPT
SCHEMBL4118643 0.79 CA12 (0.52) CA12CA1CA2CA9KMT2A
SCHEMBL993752 0.77 MAPT (0.58) CA12CA1CA2CA9KMT2A
SCHEMBL4126847 0.77 ALDH1A1 (0.54) CA12CA1CA2CA9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318782-B2 Mitotic kinesin inhibitor KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-11-27 US disclosed
EP-1847534-B9 Thiadiazoline derivatives for treating cancer KYOWA HAKKO KIRIN CO LTD (JP) 2012-03-21 EP disclosed
US-20110275827-A1 Mitotic Kinesin Inhibitor FUJIFILM CORPORATION (JP) 2011-11-10 US disclosed
EP-1454903-B9 Thiadiazoline derivatives for treating cancer KYOWA HAKKO KIRIN CO LTD (JP) 2011-10-05 EP disclosed
EP-1847534-B1 Thiadiazoline derivatives for treating cancer KYOWA HAKKO KIRIN CO LTD (JP) 2011-06-22 EP disclosed
EP-2327702-A1 Mitotic kinesin inhibitor Kyowa Hakko Kirin Co., Ltd. (JP) 2011-06-01 EP disclosed
US-7910611-B2 Therapeutic agent for restenosis KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-03-22 US disclosed
US-7902234-B2 Thiadiazoline derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-03-08 US disclosed
US-20110004000-A1 Mitotic Kinesin Inhibitor KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-01-06 US disclosed
US-7851635-B2 Mitotic kinesin inhibitor KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-12-14 US disclosed
US-20080194653-A1 Therapeutic Agent For Solid Tumor KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-08-14 US disclosed
EP-1908755-A1 THERAPEUTIC AGENT FOR RESTENOSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-04-09 EP disclosed
EP-1870404-A1 AGENT FOR TREATMENT OF HEMATOPOIETIC TUMOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-12-26 EP disclosed
EP-1867640-A1 AGENT FOR TREATMENT OF SOLID TUMOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-12-19 EP disclosed
EP-1847534-A2 Thiadiazoline derivative Kyowa Hakko Kogyo Co., Ltd (JP) 2007-10-24 EP disclosed
US-20070213380-A1 Thiadiazoline derivative KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-09-13 US disclosed
US-20070155804-A1 Mitotic kinesin inhibitor KYOWA HAKKO KOGYO CO., LTD. OF TOKYO, JAPAN FUJI PHOTO FILM CO., LTD. KANAGAWA, JAPAN 2007-07-05 US disclosed
US-20060074113-A1 Thiadiazoline derivative KYOWA KIRIN CO., LTD. (JP) 2006-04-06 US disclosed
EP-1616866-A1 M-STAGE KINESIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-01-18 EP disclosed
EP-1454903-A1 THIADIAZOLINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-09-08 EP 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 (6 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-20060074113-A1 Thiadiazoline derivative BRWD1, RB1, ARG2 CA12 4720/4885CA1 4761/4885CA2 4175/4885
US-20070155804-A1 Mitotic kinesin inhibitor KIF15, KIF5A, KIF5B CA12 4520/4885CA1 4204/4885CA2 2863/4885
US-20070213380-A1 Thiadiazoline derivative BRWD1, RB1, ARG2 CA12 4720/4885CA1 4761/4885CA2 4175/4885
US-20110004000-A1 Mitotic Kinesin Inhibitor KIF15, KIF5A, KIF5B CA12 4520/4885CA1 4204/4885CA2 2863/4885
US-20080194653-A1 Therapeutic Agent For Solid Tumor HRH3, TP53, VHL CA12 1919/4885CA1 3403/4885CA2 2864/4885
US-20110275827-A1 Mitotic Kinesin Inhibitor KIF15, KIF5A, KIF5B CA12 4520/4885CA1 4204/4885CA2 2863/4885

“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.