SCHEMBL10344697

SCHEMBL10344697

O=C(Nc1ccccc1)Nc1ccncc1Cl

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.68
HTT P42858 2/20 0.67
IMPDH2 P12268 3/20 0.63
TAAR1 Q96RJ0 1/20 0.62
KMT2A Q03164 10/20 0.59
MEN1 O00255 9/20 0.59
MAPT P10636 4/20 0.59
RAB9A P51151 3/20 0.59
KDM4E B2RXH2 3/20 0.59
MAPK1 P28482 2/20 0.59
NPC1 O15118 2/20 0.59
GAA P10253 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
LMNA P02545 2/20 0.56
CASP3 P42574 1/20 0.55
SENP8 Q96LD8 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
TP53 P04637 1/20 0.53

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
SCHEMBL11049829 0.81 NPC1 (0.66) POLBHTTIMPDH2TAAR1KMT2A
SCHEMBL22926342 0.80 HTT (1.00) POLBHTTKMT2AMEN1MAPT
SCHEMBL26921540 0.80 GALR3 (0.54) POLBHTTKMT2AMEN1MAPT
SCHEMBL1700678 0.80 MEN1 (0.87) POLBHTTKMT2AMEN1MAPT
SCHEMBL22125179 0.80 SMARCA2 (0.71) POLBHTTKMT2AMEN1MAPT
SCHEMBL26229535 0.78 TAAR1 (0.62) POLBHTTIMPDH2TAAR1KMT2A
SCHEMBL305498 0.77 TAAR1 (1.00) POLBHTTIMPDH2TAAR1KMT2A
SCHEMBL8946928 0.77 TAAR1 (0.60) POLBHTTIMPDH2TAAR1MAPT
SCHEMBL10665495 0.76 RAB9A (0.79) HTTTAAR1KMT2AMEN1MAPT
SCHEMBL28072777 0.76 JAK2 (0.67) HTTKMT2AMEN1TDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200383331-A1 COMPOSITIONS AND METHODS FOR LARGE-SCALE IN VITRO PLANT BIOCULTURE BOOSHOOT LLC (US) 2020-12-10 US disclosed
WO-2013016198-A1 COMPOSITIONS, METHODS, AND SYSTEMS FOR MICROPROPAGATION OF PLANTS BOOSHOOT LLC (US) 2013-01-31 WO disclosed
WO-2012097380-A1 COMPOSITIONS AND METHODS FOR BAMBOO PULPING The Red Triangle, LLC (US) 2012-07-19 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-20200383331-A1 COMPOSITIONS AND METHODS FOR LARGE-SCALE IN VITRO PLANT BIOCULTURE MYB, MYCBP, PIM1 POLB 944/4885HTT 424/4885IMPDH2 4405/4885

“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.