SCHEMBL56183

SCHEMBL56183

O=C(CI)c1nc(=O)oc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 5/20 0.39
GLA P06280 3/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 3/20 0.39
CYP3A4 P08684 2/20 0.39
HSD17B10 Q99714 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAOA P21397 2/20 0.39
PGAM1 P18669 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
NQO1 P15559 2/20 0.38
LMNA P02545 4/20 0.37
TSHR P16473 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
USP2 O75604 1/20 0.37
CSNK2A2 P19784 1/20 0.37
PTGS1 P23219 1/20 0.37

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
Carsalam SCHEMBL17844931 0.71 CA12 (0.48) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL8443182 0.70 ALDH1A1 (0.47) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL12820358 0.68 KCNH2 (0.66) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL4828662 0.67 KDM4E (0.48) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL3829227 0.67 KDM4E (0.50) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL10691933 0.67 KDM4E (0.49) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL27978400 0.67 AKR1C3 (0.53) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL27902923 0.66 KDM4E (0.42) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL17471553 0.64 MAPT (0.47) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL8251751 0.64 ALDH1A1 (0.44) KDM4EALDH1A1GLAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129525-B2 Long wavelength thiol-reactive fluorophores BECTON DICKINSON AND COMPANY (US) 2012-03-06 US disclosed
US-8071794-B2 Long wavelength thiol-reactive fluorophores BECTON, DICKINSON AND COMPANY (US) 2011-12-06 US disclosed
US-20110184168-A1 LONG WAVELENGTH THIOL-REACTIVE FLUOROPHORES BECTON, DICKINSON AND COMPANY (US) 2011-07-28 US disclosed
EP-2223971-A1 Long wavelength thiol-reactive fluorophores Becton, Dickinson & Company (US) 2010-09-01 EP disclosed
US-7767821-B2 Long wavelength thiol-reactive fluorophores BECTON, DICKINSON & COMPANY (US) 2010-08-03 US disclosed
US-20100167417-A1 LONG WAVELENGTH THIOL-REACTIVE FLUOROPHORES BECTON, DICKINSON AND COMPANY (US) 2010-07-01 US disclosed
US-20100003763-A1 LONG WAVELENGTH THIOL-REACTIVE FLUOROPHORES BECTON, DICKINSON AND COMPANY (US) 2010-01-07 US disclosed
US-7563891-B2 Long wavelength thiol-reactive fluorophores BECTON, DICKINSON & COMPANY (US) 2009-07-21 US disclosed
EP-2036953-A2 Long wavelength thiol-reactive fluorophores Becton, Dickinson & Company (US) 2009-03-18 EP disclosed
EP-1751236-A2 LONG WAVELENGTH THIOL-REACTIVE FLUOROPHORES Becton, Dickinson & Company (US) 2007-02-14 EP disclosed
US-20060280652-A1 Long wavelength thiol-reactive fluorophores BECTON, DICKINSON AND COMPANY 2006-12-14 US disclosed
WO-2006025887-A2 LONG WAVELENGTH THIOL-REACTIVE FLUOROPHORES BECTON, DICKINSON AND COMPANY (US) 2006-03-09 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 (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-20100167417-A1 LONG WAVELENGTH THIOL-REACTIVE FLUOROPHORES NUCB2, NDC1, NCBP1 KDM4E 3540/4885ALDH1A1 1435/4885GLA 3518/4885
US-20100003763-A1 LONG WAVELENGTH THIOL-REACTIVE FLUOROPHORES NUCB2, NDC1, NCBP1 KDM4E 3540/4885ALDH1A1 1435/4885GLA 3518/4885
US-20110184168-A1 LONG WAVELENGTH THIOL-REACTIVE FLUOROPHORES NUCB2, NDC1, NCBP1 KDM4E 3540/4885ALDH1A1 1435/4885GLA 3518/4885

“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.