SCHEMBL140123

SCHEMBL140123

Clc1nc(Cl)nc(NCCCCCCNc2nc(Cl)nc(Cl)n2)n1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
LMNA P02545 1/20 0.50
CA12 O43570 4/20 0.42
CA1 P00915 4/20 0.42
CA2 P00918 4/20 0.42
CA9 Q16790 4/20 0.42
CA14 Q9ULX7 3/20 0.42
NR1I2 O75469 1/20 0.41
AHR P35869 1/20 0.41
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
KCNH3 Q9ULD8 1/20 0.38
PKM P14618 1/20 0.37
RAD52 P43351 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
SCHEMBL20053796 0.97 KMT2A (0.58) KMT2ALMNACA12CA1CA2
SCHEMBL13558679 0.92 KMT2A (0.53) KMT2ALMNACA12CA1CA2
SCHEMBL2328267 0.89 KMT2A (0.77) KMT2ALMNANR1I2AHRKCNH3
SCHEMBL1562316 0.89 KMT2A (0.77) KMT2ALMNANR1I2AHRKCNH3
SCHEMBL10912439 0.89 KMT2A (0.77) KMT2ALMNANR1I2AHRKCNH3
SCHEMBL7937257 0.89 KMT2A (0.77) KMT2ALMNANR1I2AHRKCNH3
SCHEMBL17563553 0.89 KMT2A (0.77) KMT2ALMNANR1I2AHRKCNH3
SCHEMBL2238412 0.89 KMT2A (0.77) KMT2ALMNANR1I2AHRKCNH3
SCHEMBL11083082 0.87 LMNA (0.56) KMT2ALMNACA12CA1CA2
SCHEMBL616128 0.87 KMT2A (0.74) KMT2ALMNANR1I2AHRKCNH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9034955-B2 High molecular weight nonpolar benzotriazoles BASF SE (DE) 2015-05-19 US disclosed
US-9034955-B2 High molecular weight nonpolar benzotriazoles BASF SE (DE) 2015-05-19 US disclosed
EP-2430089-B1 HIGH MOLECULAR WEIGHT NON-POLAR BENZOTRIAZOLES BASF SE (DE) 2013-07-31 EP disclosed
EP-2430089-A2 HIGH-MOLECULAR NON-POLAR BENZTRIAZOLES BASF SE (DE) 2012-03-21 EP disclosed
US-20120059095-A1 HIGH MOLECULAR WEIGHT NONPOLAR BENZOTRIAZOLES BASF SE (DE) 2012-03-08 US disclosed
US-20120059095-A1 HIGH MOLECULAR WEIGHT NONPOLAR BENZOTRIAZOLES BASF SE (DE) 2012-03-08 US disclosed
WO-2010130752-A2 HIGH-MOLECULAR NON-POLAR BENZTRIAZOLES BASF SE (DE) 2010-11-18 WO disclosed
WO-2010130752-A2 HIGH-MOLECULAR NON-POLAR BENZTRIAZOLES BASF SE (DE) 2010-11-18 WO disclosed
US-5118736-A Polymer stabilization against actinic radiation CIBA-GEIGY CORPORATION (US) 1992-06-02 US disclosed
EP-0389428-A2 N,N-Bis(l-hydroxycarbyloxy-2,2,6,6-tetramethyl-piperidin-4-yl) amino triazines and stabilized compositions CIBA-GEIGY AG (CH) 1990-09-26 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 (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-20120059095-A1 HIGH MOLECULAR WEIGHT NONPOLAR BENZOTRIAZOLES SULT1A1, TPST2, SULT2A1 KMT2A 255/4885LMNA 3686/4885CA12 2439/4885

“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.