SCHEMBL19737585

SCHEMBL19737585

Cc1nc(-c2cnc3ccc(C(C)C)cn23)n[nH]1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 10/20 0.39
TGFBR1 P36897 2/20 0.39
JAK2 O60674 4/20 0.36
JAK3 P52333 4/20 0.36
JAK1 P23458 3/20 0.36
TDP1 Q9NUW8 1/20 0.33
RXRA P19793 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
KIT P10721 1/20 0.32

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
SCHEMBL20125086 0.83 CYP1A2 (0.46) EIF2AK4TGFBR1PRMT5WDR77
SCHEMBL15829283 0.82 EIF2AK4 (0.46) EIF2AK4TGFBR1
SCHEMBL22955952 0.72 RXRA (0.31) EIF2AK4TGFBR1JAK2JAK3JAK1
SCHEMBL22521532 0.72 TGFBR1 (0.41) EIF2AK4TGFBR1RXRA
SCHEMBL14773395 0.70 FLT3 (0.54) TGFBR1JAK2JAK3JAK1
SCHEMBL13976120 0.69 LMNA (0.39) EIF2AK4TGFBR1JAK2JAK3JAK1
SCHEMBL11994463 0.69 HDAC3 (0.53) TDP1
SCHEMBL22212202 0.68 FLT1 (0.36) EIF2AK4TGFBR1RXRA
SCHEMBL23511269 0.67 DGAT1 (0.40)
SCHEMBL22944713 0.67 NPC1 (0.35)

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
EP-3318557-A2 QUINOLONE COMPOUND Otsuka Pharmaceutical Co., Ltd. (JP) 2018-05-09 EP disclosed
US-20170362180-A1 QUINOLONE COMPOUND OTSUKA PHARMA CO LTD (JP) 2017-12-21 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-20170362180-A1 QUINOLONE COMPOUND HAX1, NQO2, NHERF1 EIF2AK4 2446/4885TGFBR1 4462/4885JAK2 2624/4885

“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.