SCHEMBL2158114

SCHEMBL2158114

COc1cc2c(Oc3ccc(NC(=O)c4c(C)n(C)n(-c5ccccc5)c4=O)nc3)ccnc2cc1O

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 18/20 0.90
MET P08581 18/20 0.90
KDR P35968 17/20 0.90
EIF2AK3 Q9NZJ5 2/20 0.75
EIF2AK4 Q9P2K8 1/20 0.75
AURKA O14965 1/20 0.64
JAK2 O60674 1/20 0.64
RPS6KA5 O75582 1/20 0.64
ABL1 P00519 1/20 0.64
INSR P06213 1/20 0.64
LCK P06239 1/20 0.64
FES P07332 1/20 0.64
CSF1R P07333 1/20 0.64
LYN P07948 1/20 0.64
RET P07949 1/20 0.64
FGR P09769 1/20 0.64
KIT P10721 1/20 0.64
PIM1 P11309 1/20 0.64
FGFR1 P11362 1/20 0.64
SRC P12931 1/20 0.64

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
SCHEMBL199328 0.90 IGF1R (1.00) IGF1RMETKDRAURKAJAK2
SCHEMBL12004132 0.90 MET (0.73) IGF1RMETKDREIF2AK3EIF2AK4
SCHEMBL200894 0.88 MET (0.88) IGF1RMETKDREIF2AK3EIF2AK4
SCHEMBL2157881 0.88 IGF1R (0.85) IGF1RMETKDREIF2AK3EIF2AK4
SCHEMBL12018172 0.88 MET (0.86) IGF1RMETKDREIF2AK3EIF2AK4
SCHEMBL197977 0.87 IGF1R (0.86) IGF1RMETKDREIF2AK3EIF2AK4
SCHEMBL197974 0.87 MET (0.85) IGF1RMETKDREIF2AK3EIF2AK4
SCHEMBL198585 0.85 IGF1R (0.86) IGF1RMETKDREIF2AK3EIF2AK4
SCHEMBL198198 0.85 MET (0.82) IGF1RMETKDREIF2AK3EIF2AK4
SCHEMBL198203 0.84 IGF1R (0.88) IGF1RMETKDRAURKAJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2532657-B9 Compounds and methods of use SUNSHINE LAKE PHARMA CO LTD (CN) 2017-04-19 EP disclosed
EP-2532657-B1 Compounds and methods of use SUNSHINE LAKE PHARMA CO LTD (CN) 2016-08-31 EP disclosed
US-8426585-B2 Compounds comprising a spiro-ring Xi, Ning (US) 2013-04-23 US disclosed
US-20120315247-A1 COMPOUNDS COMPRISING A SPIRO-RING AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2012-12-13 US disclosed
US-8293897-B2 Compounds comprising a spiro-ring and methods of use Xi, Ning (US) 2012-10-23 US disclosed
EP-2340244-A1 COMPOUNDS AND METHODS OF USE Xi, Ning (US) 2011-07-06 EP disclosed
WO-2010045095-A1 COMPOUNDS AND METHODS OF USE XI NING (US) 2010-04-22 WO disclosed
US-20100093727-A1 COMPOUNDS AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2010-04-15 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 (2 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-20100093727-A1 COMPOUNDS AND METHODS OF USE PRKDC, PRKACA, PRKX IGF1R 493/4885MET 302/4885KDR 600/4885
US-20120315247-A1 COMPOUNDS COMPRISING A SPIRO-RING AND METHODS OF USE CDC42BPG, HRAS, PTPRJ IGF1R 614/4885MET 732/4885KDR 728/4885

“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.