SCHEMBL15854649

SCHEMBL15854649

CN1CCN(c2cccc(C3=CCc4ccc(-c5nnc(S(C)(=O)=O)s5)cc43)n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 17/20 0.53
▸ PIM3 Q86V86 16/20 0.53
▸ PIM2 Q9P1W9 15/20 0.53
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HTR3E A5X5Y0 2/20 0.34
▸ HTR3B O95264 2/20 0.34
▸ HTR3A P46098 2/20 0.34
▸ HTR3D Q70Z44 2/20 0.34
▸ HTR3C Q8WXA8 2/20 0.34

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
SCHEMBL15854652 0.91 PIM1 (0.65) PIM1PIM3PIM2
SCHEMBL15854667 0.79 PIM1 (0.45) PIM1PIM3PIM2
SCHEMBL15854638 0.77 PIM1 (0.51) PIM1PIM3PIM2KDM4EMEN1
SCHEMBL15854657 0.76 PIM1 (0.63) PIM1PIM3PIM2
SCHEMBL15854653 0.75 PIM1 (0.64) PIM1PIM3PIM2
SCHEMBL15854660 0.74 GUSB (0.38) PIM1PIM3PIM2KDM4E
SCHEMBL12616297 0.73 PIM1 (0.52) PIM1PIM3PIM2
SCHEMBL15854687 0.72 PIM1 (0.41) PIM1PIM3PIM2
SCHEMBL15854650 0.72 PIM1 (0.38) PIM1PIM3PIM2
SCHEMBL15854692 0.71 PIM1 (0.37) PIM1PIM3PIM2KDM4ECYP3A4

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-9321756-B2 Azole compounds as PIM inhibitors AMGEN INC. (US) 2016-04-26 — — US disclosed
US-20140187553-A1 Azole Compounds as PIM Inhibitors AMGEM INC. (US) 2014-07-03 — — 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-20140187553-A1 Azole Compounds as PIM Inhibitors PIM1, PIM3, PIM2 PIM1 1/4885PIM3 2/4885PIM2 3/4885

“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.

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