SCHEMBL11269609

SCHEMBL11269609

COCCNc1ncnc(NC(C)(C)C)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH3 Q9ULD8 5/20 0.45
▸ LMNA P02545 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ KMT2A Q03164 1/20 0.41
▸ LDHA P00338 1/20 0.40
▸ HTR7 P34969 1/20 0.40
▸ MKNK1 Q9BUB5 1/20 0.38
▸ MKNK2 Q9HBH9 1/20 0.38
▸ HCAR3 P49019 1/20 0.36
▸ CYP1A2 P05177 3/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ CLK4 Q9HAZ1 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ TSHR P16473 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
SCHEMBL30785004 0.88 KCNH3 (0.54) KCNH3LMNAHTTLDHAHTR7
SCHEMBL8464395 0.80 KMT2A (0.46) LMNAKMT2AHTR7CYP1A2CYP2C19
SCHEMBL10748221 0.78 SMN1; SMN2 (0.52) LMNAKMT2ACYP1A2CYP2C19ALDH1A1
SCHEMBL7057840 0.78 LMNA (0.50) LMNAKMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL10879108 0.73 KCNH3 (0.46) KCNH3LMNAHTTKMT2ALDHA
SCHEMBL8854525 0.71 KCNH3 (0.49) KCNH3LMNAHTTHTR7ALDH1A1
SCHEMBL11269602 0.70 GAA (0.38) LMNAKMT2AHTR7CYP1A2CYP2C19
SCHEMBL24650717 0.70 MKNK1 (0.48) KCNH3HTR7MKNK1MKNK2CYP1A2
SCHEMBL7906733 0.69 SMN1; SMN2 (0.37) KCNH3LMNAHTTLDHAHTR7
SCHEMBL12412535 0.68 KCNH3 (0.41) KCNH3LMNAHTTKMT2ALDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4309210-A HERBICIDE AND SAFENING AGENT CIBA-GEIGY CORPORATION (US) 1982-01-05 — — US disclosed
EP-0012717-A1 Method and composition for the selective pre-emergent control of weeds in cereal cultures CIBA-GEIGY AG (CH) 1980-06-25 — — EP disclosed
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