SCHEMBL9904589

SCHEMBL9904589

CC(C)(C)OC(=O)NC1CCCN(c2cncc(-c3nn(C4CCCCO4)c4ccc(-c5c(F)cccc5F)cc34)n2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 3/20 0.45
▸ PIM3 Q86V86 3/20 0.45
▸ PIM2 Q9P1W9 3/20 0.45
▸ AURKA O14965 3/20 0.43
▸ PDPK1 O15530 3/20 0.43
▸ AURKB Q96GD4 3/20 0.43
▸ SYK P43405 2/20 0.41
▸ JAK3 P52333 2/20 0.40
▸ BTK Q06187 1/20 0.40
▸ ALOX5AP P20292 1/20 0.40
▸ FEN1 P39748 1/20 0.40
▸ RET P07949 3/20 0.39
▸ MAP4K4 O95819 2/20 0.39
▸ EGFR P00533 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ BRD4 O60885 2/20 0.38
▸ CKS1B P61024 1/20 0.37
▸ SKP1 P63208 1/20 0.37
▸ SKP2 Q13309 1/20 0.37
▸ DPP4 P27487 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
SCHEMBL9904770 0.86 CKS1B (0.45) PIM1PIM3PIM2SYKRET
SCHEMBL15440351 0.83 CKS1B (0.41) ALOX5APFEN1RETCKS1BSKP1
SCHEMBL9904737 0.82 WNT1 (0.39) BTKALOX5APFEN1RETBRD4
SCHEMBL9904148 0.82 PIM1 (0.48) PIM1PIM3PIM2
SCHEMBL9904147 0.82 PIM1 (0.48) PIM1PIM3PIM2
SCHEMBL9904145 0.82 PIM1 (0.48) PIM1PIM3PIM2
SCHEMBL9904327 0.81 CKS1B (0.44) SYKJAK3BTKRETCKS1B
SCHEMBL15440453 0.80 AURKA (0.46) PIM1PIM3PIM2AURKAPDPK1
SCHEMBL9904300 0.80 BTK (0.41) PIM1PIM2SYKBTKEGFR
SCHEMBL9904303 0.80 BTK (0.41) PIM1PIM2SYKBTKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 — — US disclosed
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 — — US disclosed
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 — — US disclosed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 — — US disclosed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 — — US disclosed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 — — US disclosed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 — — EP disclosed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 — — WO disclosed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 — — 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-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS PIM1, PIM2, PIM3 PIM1 1/4885PIM3 3/4885PIM2 2/4885

“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.

Send feedback