SCHEMBL65944

SCHEMBL65944

Fc1[c]sc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.40
EPAS1 Q99814 2/20 0.33
PMM2 O15305 1/20 0.32
MPI P34949 1/20 0.32
RAB9A P51151 1/20 0.32
PHOSPHO1 Q8TCT1 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
G6PD P11413 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
HSD17B10 Q99714 1/20 0.31
DDAH1 O94760 1/20 0.31
LMNA P02545 1/20 0.31
CASP3 P42574 1/20 0.31
HTT P42858 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
CYP2A6 P11509 1/20 0.30
IDO1 P14902 1/20 0.30

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
SCHEMBL695407 0.74 TRIM58 (0.41) ALDH1A1
SCHEMBL317826 0.73 GPR3 (0.42) GPR3EPAS1RAB9AG6PDKDM4E
SCHEMBL66254 0.71 GPR3 (0.40) GPR3EPAS1PMM2MPIG6PD
SCHEMBL767077 0.71 GPR3 (0.40) GPR3EPAS1RAB9AKDM4EALDH1A1
SCHEMBL66184 0.71 GPR3 (0.40) GPR3EPAS1PMM2MPIRAB9A
SCHEMBL3525196 0.71 EPHX2 (0.36) GPR3PMM2MPIPHOSPHO1ALDH1A1
SCHEMBL3529744 0.69 GPR3 (0.33) GPR3
SCHEMBL2956882 0.68 GPR3 (0.37) GPR3EPAS1ALDH1A1LMNAHTT
SCHEMBL3529881 0.68 SMN1; SMN2 (0.33) RAB9AKDM4EALDH1A1MAPTHSD17B10
SCHEMBL3526679 0.67 GPR3 (0.36) GPR3KDM4EALDH1A1MAPTCACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8852937-B2 Small organic molecule regulators of cell proliferation CURIS, INC. (US) 2014-10-07 US claimed
US-8129425-B2 Contacting cell with hedgehog antagonist; moderator of cell proliferative, cell differentiation CURIS, INC. (US) 2012-03-06 US claimed
US-20060287385-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2006-12-21 US claimed
US-7115653-B2 Small organic molecule regulators of cell proliferation CURIS, INC. (US) 2006-10-03 US claimed
EP-1436287-A4 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION CURIS INC (US) 2005-10-26 EP claimed
US-20050070578-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2005-03-31 US claimed
EP-1436287-A2 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION Curis, Inc. (US) 2004-07-14 EP claimed
WO-2003027234-A9 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION CURIS INC (US) 2004-02-19 WO claimed
US-6683192-B2 SUBSTITUTED BENZO(B)THIEN COMPOUNDS USEFUL FOR MODULATING PROLIFERATION OR DIFFERENTIATION OF A CELL, AGONIZES HEDGEHOG MEDIATED SIGNAL TRASNDUCTION WITH AN ED50 OF 1MM OR LESS CURIS, INC. 2004-01-27 US claimed
US-20030139457-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2003-07-24 US claimed
WO-2003027234-A2 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION CURIS, INC. (US) 2003-04-03 WO claimed
US-20020198236-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2002-12-26 US claimed
US-8852937-B2 Small organic molecule regulators of cell proliferation CURIS, INC. (US) 2014-10-07 US disclosed
US-20120269863-A1 METHODS AND COMPOSITIONS FOR REGULATING LYMPHOCYTE ACTIVITY CURIS, INC. (US) 2012-10-25 US disclosed
US-20120245184-A1 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION ADERANS RESEARCH INSTITUTE, INC. 2012-09-27 US disclosed
US-8273747-B2 tert-Butyl (4-((4'-cyano-4-methoxy-biphenyl-3-ylmethyl)-amino)-cyclohexyl)-methyl-carbamate; hedgehog pathway agonists; alopecia; angiogenesis; wound healing; alzheimer's disease; inhibit aging effects on skin CURIS, INC. (US) 2012-09-25 US disclosed
US-4895587-A Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1990-01-23 US disclosed
EP-0206251-B1 HALOACETAMIDE COMPOUNDS, PROCESS FOR PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDE TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1988-09-07 EP disclosed
EP-0206251-A1 Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1986-12-30 EP disclosed
EP-0189774-A1 Process for production of N,N-disubstituted carboxylic acid amides TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1986-08-06 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-20020198236-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO GPR3 476/4885EPAS1 1250/4885PMM2 4081/4885
US-20120245184-A1 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION GLI1, SHH, SMO GPR3 702/4885EPAS1 1025/4885PMM2 3436/4885
US-20060287385-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO GPR3 476/4885EPAS1 1250/4885PMM2 4081/4885
US-20120269863-A1 METHODS AND COMPOSITIONS FOR REGULATING LYMPHOCYTE ACTIVITY SHH, ICOS, SMO GPR3 480/4885EPAS1 1037/4885PMM2 4518/4885
US-20030139457-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO GPR3 476/4885EPAS1 1250/4885PMM2 4081/4885
US-20050070578-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO GPR3 476/4885EPAS1 1250/4885PMM2 4081/4885

“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.