SCHEMBL2736838

SCHEMBL2736838

CCCNC(=O)N(O)c1cc(C(F)(F)F)ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ POLB P06746 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ GRM5 P41594 1/20 0.45
▸ TP53 P04637 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ UBE2M P61081 1/20 0.39
▸ DCUN1D1 Q96GG9 1/20 0.39
▸ HCRTR1 O43613 1/20 0.39

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
SCHEMBL879518 0.90 MAPT (0.50) MAPTKDM4EPOLBALDH1A1KMT2A
SCHEMBL10067207 0.86 ALDH1A1 (0.48) MAPTKDM4EPOLBALDH1A1KMT2A
SCHEMBL13543371 0.81 RAB9A (0.47) KDM4EPOLBKMT2AMEN1NPSR1
SCHEMBL879553 0.79 MAPT (0.47) MAPTKDM4EKMT2AMEN1GRM5
SCHEMBL17681643 0.78 MAPT (0.50) MAPTKDM4EALDH1A1GRM5TP53
SCHEMBL879555 0.76 HPGD (0.44) POLBALDH1A1KMT2AMEN1NPSR1
SCHEMBL10067058 0.76 ALDH1A1 (0.59) POLBALDH1A1KMT2AMEN1TP53
SCHEMBL10067206 0.75 TAS2R14 (0.39) MAPTKDM4EPOLBALDH1A1KMT2A
SCHEMBL18883304 0.72 MAPT (0.80) MAPTKDM4EPOLBALDH1A1GRM5
SCHEMBL879552 0.71 SMN1; SMN2 (0.43) POLBALDH1A1KMT2AMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9677053-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2017-06-13 — — US disclosed
US-9677053-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2017-06-13 — — US disclosed
US-20160237411-A1 LACCASES FOR BIO-BLEACHING VERENIUM CORPORATION 2016-08-18 — — US disclosed
US-20160237411-A1 LACCASES FOR BIO-BLEACHING VERENIUM CORPORATION 2016-08-18 — — US disclosed
US-9353477-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2016-05-31 — — US disclosed
US-9353477-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2016-05-31 — — US disclosed
EP-2434008-B1 Laccases for pulp bio-bleaching BASF ENZYMES LLC (US) 2015-07-08 — — EP disclosed
US-20150125936-A1 LACCASES FOR BIO-BLEACHING BASF SE (DE) 2015-05-07 — — US disclosed
US-20150125936-A1 LACCASES FOR BIO-BLEACHING BASF SE (DE) 2015-05-07 — — US disclosed
US-8951766-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2015-02-10 — — US disclosed
US-8951766-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2015-02-10 — — US disclosed
US-20130126110-A1 LACCASES FOR BIO-BLEACHING BASF SE (DE) 2013-05-23 — — US disclosed
US-20130126110-A1 LACCASES FOR BIO-BLEACHING BASF SE (DE) 2013-05-23 — — US disclosed
US-8377670-B2 Laccases for bio-bleaching VERENIUM CORPORATION (US) 2013-02-19 — — US disclosed
US-8377670-B2 Laccases for bio-bleaching VERENIUM CORPORATION (US) 2013-02-19 — — US disclosed
EP-2059587-B1 LACCASES FOR PULP BIO-BLEACHING VERENIUM CORP (US) 2012-01-04 — — EP disclosed
US-20100018658-A1 Laccases for Bio-Bleaching VERENIUM CORPORATION (US) 2010-01-28 — — US disclosed
US-20100018658-A1 Laccases for Bio-Bleaching VERENIUM CORPORATION (US) 2010-01-28 — — US disclosed
WO-2008027501-A2 LACCASES FOR PULP BIO-BLEACHING VERENIUM CORPORATION (US) 2008-03-06 — — 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 (1 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-20100018658-A1 Laccases for Bio-Bleaching AOX1, GUSB, LPO MAPT 1646/4885KDM4E 1409/4885POLB 62/4885

“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.

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