SCHEMBL2605876

SCHEMBL2605876

O=C(Nc1ccccc1C(=O)N/N=C/c1ccccc1O)c1ccccc1Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.66
KMT2A Q03164 3/20 0.65
HPGD P15428 3/20 0.65
KDM4E B2RXH2 2/20 0.65
MEN1 O00255 2/20 0.65
TP53 P04637 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2D6 P10635 1/20 0.65
MAPK1 P28482 1/20 0.65
HSD17B10 Q99714 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
MAPT P10636 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
LMNA P02545 1/20 0.62
ALOX12 P18054 1/20 0.62
HTT P42858 1/20 0.62
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
KDM1A O60341 2/20 0.55
MAOA P21397 1/20 0.55

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
SCHEMBL6570171 0.81 KDM4E (0.77) PPARGKMT2AHPGDKDM4EMEN1
SCHEMBL6570164 0.81 KDM4E (0.77) PPARGKMT2AHPGDKDM4EMEN1
SCHEMBL684522 0.81 KMT2A (0.74) KMT2AHPGDKDM4EMEN1TP53
SCHEMBL14949045 0.80 EGFR (0.82) KMT2AHPGDKDM4EMEN1TP53
SCHEMBL76811 0.80 MEN1 (1.00) KMT2AHPGDKDM4EMEN1TP53
SCHEMBL1173698 0.80 MEN1 (1.00) KMT2AHPGDKDM4EMEN1TP53
SCHEMBL414436 0.80 MEN1 (1.00) KMT2AHPGDKDM4EMEN1TP53
SCHEMBL29599618 0.80 MEN1 (1.00) KMT2AHPGDKDM4EMEN1TP53
SCHEMBL29379900 0.80 MEN1 (1.00) KMT2AHPGDKDM4EMEN1TP53
SCHEMBL685227 0.79 KMT2A (0.63) KMT2AHPGDKDM4EMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120135864-A1 POLLINATION IMPROVER TAMINCO, NAAMLOZE VENNOOTSCHAP (BE) 2012-05-31 US disclosed
US-20120108431-A1 PLANT GROWTH REGULATOR ADDITIVE TAMINCO, NAAMLOZE VENNOOTSCHAP (BE) 2012-05-03 US disclosed
US-20120101164-A1 ABSCISSION AND CROP STORAGE UNIT TAMINCO, NAAMLOZE VENNOOTSCHAP (BE) 2012-04-26 US disclosed
US-20120088667-A1 SAFENING AGENT TAMINCO, NAAMLOZE VENNOOTSCHAP (BE) 2012-04-12 US 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 (4 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-20120101164-A1 ABSCISSION AND CROP STORAGE UNIT BROX, ACR, ABAT PPARG 1726/4885KMT2A 4125/4885HPGD 720/4885
US-20120088667-A1 SAFENING AGENT PIN1, IPO11, XPO1 PPARG 268/4885KMT2A 4263/4885HPGD 417/4885
US-20120135864-A1 POLLINATION IMPROVER AADAT, TIPARP, GSR PPARG 485/4885KMT2A 3315/4885HPGD 1398/4885
US-20120108431-A1 PLANT GROWTH REGULATOR ADDITIVE MYB, ING2, AGXT PPARG 376/4885KMT2A 710/4885HPGD 2457/4885

“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.