SCHEMBL1234403

SCHEMBL1234403

CCc1c(Br)cnn1CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
NPC1 O15118 3/20 0.37
MEN1 O00255 3/20 0.37
ATM Q13315 1/20 0.37
HPGD P15428 1/20 0.37
ALDH1A1 P00352 4/20 0.37
RAB9A P51151 4/20 0.37
MITF O75030 2/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
S1PR4 O95977 1/20 0.37
S1PR1 P21453 1/20 0.37
TSHR P16473 3/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.34
GRM2 Q14416 1/20 0.34
BLM P54132 1/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL1234673 0.83 POLB (0.38) KMT2ANPC1MEN1ATMHPGD
SCHEMBL24896500 0.77 MPO (0.33) KMT2ANPC1MEN1ATMHPGD
SCHEMBL13990286 0.76
SCHEMBL13714026 0.76
SCHEMBL14685621 0.76 HTT (0.39) KMT2ANPC1HPGDALDH1A1RAB9A
SCHEMBL6978183 0.74
SCHEMBL23400969 0.74 HTT (0.38) KMT2ANPC1HPGDRAB9ASMN1; SMN2
SCHEMBL14858124 0.74 PKM (0.44) KMT2AMEN1RAB9AMAPTLMNA
SCHEMBL24526739 0.71 HPGD (0.39) KMT2ANPC1MEN1ATMHPGD
SCHEMBL8544400 0.71 NPC1 (0.64) KMT2ANPC1MEN1ATMHPGD

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-7879849-B2 such as 1-(2-Methylpropyl)-2-propyl-2H-pyrazolo[3,4-c]quinolin-4-amine, used as immunomodulators, for inducing or inhibiting cytokine biosynthesis in animals and in the treatment of viral and neoplastic diseases 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-02-01 US disclosed
US-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2009-12-24 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 (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-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL2, IL4I1 KMT2A 3149/4885NPC1 3412/4885MEN1 2683/4885

“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.