SCHEMBL883105

SCHEMBL883105

NCC(=O)c1ccc(Oc2ccc(C(=O)CN)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 8/20 0.58
PARP15 Q460N3 3/20 0.58
ALDH1A1 P00352 2/20 0.58
KMT2A Q03164 1/20 0.58
PARP14 Q460N5 1/20 0.58
PARP16 Q8N5Y8 1/20 0.58
PARP11 Q9NR21 1/20 0.58
PARP4 Q9UKK3 1/20 0.58
HPGD P15428 3/20 0.52
MAPT P10636 1/20 0.52
RAB9A P51151 1/20 0.52
ERCC5 P28715 1/20 0.52
FEN1 P39748 1/20 0.52
MMP1 P03956 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
F2 P00734 1/20 0.46
PLAU P00749 1/20 0.46
ST14 Q9Y5Y6 1/20 0.46

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
Hydrochloric Acid SCHEMBL8792040 0.90 ERCC5 (0.62) PARP10PARP15ALDH1A1KMT2APARP14
SCHEMBL564383 0.86 PARP10 (0.63) PARP10PARP15ALDH1A1KMT2APARP14
Hydrochloric Acid SCHEMBL563830 0.84 PARP10 (0.61) PARP10PARP15ALDH1A1KMT2APARP14
Hydrochloric Acid SCHEMBL13738814 0.83 GSK3B (0.42) ALDH1A1KMT2AHPGDMAPTRAB9A
SCHEMBL182867 0.83 HDAC3 (0.66) PARP10ALDH1A1PARP4MAPTRAB9A
Hydrochloric Acid SCHEMBL335070 0.81 HDAC3 (0.63) PARP10ALDH1A1PARP4MAPTRAB9A
SCHEMBL9056179 0.79 ELANE (0.56) ALDH1A1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL883159 0.78 SMN1; SMN2 (0.50) ALDH1A1HPGDMAPTRAB9AERCC5
SCHEMBL11660630 0.78 ALOX15 (0.57) ALDH1A1KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL20491355 0.78 ALOX15 (0.56) ALDH1A1KMT2ARAB9ATSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170327743-A1 LIQUID CRYSTAL DISPLAY DEVICE AND METHOD FOR MANUFACTURING SAME JNC CORP (JP) 2017-11-16 US disclosed
US-9771519-B2 Liquid crystal display device and method for manufacturing same JNC CORPORATION (JP) 2017-09-26 US disclosed
US-20170227820-A1 LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2017-08-10 US disclosed
US-20170199432-A1 LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2017-07-13 US disclosed
US-20170114277-A1 LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2017-04-27 US disclosed
US-20160369168-A1 LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-12-22 US disclosed
US-20150275089-A1 LIQUID CRYSTAL DISPLAY ELEMENT AND METHOD FOR MANUFACTURING SAME JNC PETROCHEMICAL CORPORATION (JP) 2015-10-01 US disclosed
EP-2414350-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2014-11-12 EP disclosed
US-8796466-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-05 US disclosed
WO-2012039717-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-03-29 WO disclosed
US-20110237636-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-09-29 US disclosed
US-20110237636-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-09-29 US disclosed
US-20110077280-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-03-31 US disclosed
WO-2010117635-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-10-14 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 (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-20110237636-A1 Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS PARP10 4090/4885PARP15 4303/4885ALDH1A1 2120/4885
US-20110077280-A1 Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS PARP10 4090/4885PARP15 4303/4885ALDH1A1 2120/4885

“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.