SCHEMBL1805166

SCHEMBL1805166

COC(=O)c1cccc(N(C)C(=O)c2ccc(C#N)cc2)c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.43
POLB P06746 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CYP11B1 P15538 4/20 0.41
CYP11B2 P19099 2/20 0.41
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 4/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
PLAU P00749 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL1806600 0.86 NSD2 (0.45) NSD2CYP11B1KMT2AALDH1A1NPC1
SCHEMBL1804359 0.86 CYP1A2 (0.49) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL1802256 0.85 KMT2A (0.47) POLBKMT2AALDH1A1MAPTHPGD
SCHEMBL12551321 0.81 KMT2A (0.39) KMT2AALDH1A1NPC1RAB9AMAPT
SCHEMBL21693657 0.81 NSD2 (0.39) NSD2POLBRXFP1CYP11B1CYP11B2
SCHEMBL1804690 0.79 KMT2A (0.46) POLBKMT2AALDH1A1NPC1RAB9A
SCHEMBL28034863 0.78 NSD2 (0.44) NSD2CYP11B1CYP11B2KMT2AALDH1A1
SCHEMBL1801492 0.76 TSHR (0.59) POLBRXFP1KMT2ANPC1RAB9A
SCHEMBL25208675 0.74 KMT2A (0.51) POLBKMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL15670964 0.74 MLYCD (0.44) NSD2POLBRXFP1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2322502-B1 METHOD FOR PRODUCING AMIDE DERIVATIVE MITSUI CHEMICALS AGRO INC (JP) 2019-09-18 EP disclosed
EP-2322502-B1 METHOD FOR PRODUCING AMIDE DERIVATIVE MITSUI CHEMICALS AGRO INC (JP) 2019-09-18 EP disclosed
US-9890110-B2 Method for producing amide derivative MITSUI CHEMICALS AGRO, INC. (JP) 2018-02-13 US disclosed
US-9890110-B2 Method for producing amide derivative MITSUI CHEMICALS AGRO, INC. (JP) 2018-02-13 US disclosed
US-20160297750-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2016-10-13 US disclosed
US-20160297750-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2016-10-13 US disclosed
US-9394240-B2 Method for producing amide derivative MITSUI CHEMICALS AGRO, INC. (JP) 2016-07-19 US disclosed
US-9394240-B2 Method for producing amide derivative MITSUI CHEMICALS AGRO, INC. (JP) 2016-07-19 US disclosed
US-8853440-B2 Method for producing amide derivative MITSUI CHEMICALS AGRO, INC. (JP) 2014-10-07 US disclosed
US-8853440-B2 Method for producing amide derivative MITSUI CHEMICALS AGRO, INC. (JP) 2014-10-07 US disclosed
US-20140296560-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2014-10-02 US disclosed
US-20140296560-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2014-10-02 US disclosed
US-20110137068-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE MITSUI CHEMICALS AGRO, INC. (JP) 2011-06-09 US disclosed
US-20110137068-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE MITSUI CHEMICALS AGRO, INC. (JP) 2011-06-09 US disclosed
EP-2322502-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE Mitsui Chemicals Agro, Inc. (JP) 2011-05-18 EP disclosed
EP-2322502-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE Mitsui Chemicals Agro, Inc. (JP) 2011-05-18 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 (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-20140296560-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE AFF4, AFF1, AFF2 NSD2 2962/4885POLB 4756/4885RXFP1 161/4885
US-20160297750-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE AFF4, AFF1, AFF2 NSD2 2962/4885POLB 4756/4885RXFP1 161/4885
US-20110137068-A1 METHOD FOR PRODUCING AMIDE DERIVATIVE AFF4, AFF1, AFF2 NSD2 2962/4885POLB 4756/4885RXFP1 161/4885

“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.