SCHEMBL9900445

SCHEMBL9900445

COc1cc(N2CCC(NC(=O)O)CC2)nc(Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
ALDH1A1 P00352 2/20 0.46
TSHR P16473 2/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.41
USP2 O75604 1/20 0.41
SMO Q99835 3/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38

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
SCHEMBL9942512 0.85 SUV39H2 (0.52) CKS1BSKP1SKP2
SCHEMBL9900037 0.81 HPGD (0.57) HPGDALDH1A1TSHRHSD17B10LMNA
SCHEMBL29998765 0.81 LMNA (0.51) HPGDLMNASMN1; SMN2USP2SMO
SCHEMBL2005961 0.77 MEN1 (0.52) HPGDALDH1A1TSHRHSD17B10LMNA
SCHEMBL18036125 0.75 SMN1; SMN2 (0.46) ALDH1A1SMN1; SMN2USP2
SCHEMBL4334757 0.74 TRPV1 (0.51) SMOMEN1KMT2ACKS1BSKP1
SCHEMBL5220298 0.74 LMNA (0.46) HPGDALDH1A1TSHRLMNASMN1; SMN2
SCHEMBL9900933 0.74 HPGD (0.54) HPGDALDH1A1TSHRHSD17B10SMN1; SMN2
SCHEMBL5153329 0.73 LMNA (0.67) LMNASMN1; SMN2MEN1KMT2A
SCHEMBL9900539 0.73 KMT2A (0.55) HPGDALDH1A1TSHRLMNASMN1; 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 5 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
EP-2796456-A1 Bicyclic compounds as Pim inhibitors Amgen Inc. (US) 2014-10-29 EP 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

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 HPGD 2221/4885ALDH1A1 502/4885TSHR 4529/4885

“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.