SCHEMBL20199459

SCHEMBL20199459

CCOC(=O)c1cc(Cl)nn2cc(-c3ccccc3OC)nc12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
POLB P06746 2/20 0.44
TDP1 Q9NUW8 2/20 0.42
KMT2A Q03164 1/20 0.42
ERN1 O75460 1/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL20199403 0.84 KDM4E (0.54) MAPTPOLBTDP1KMT2AKDM4E
SCHEMBL20199773 0.83 MAPT (0.47) MAPTPOLBERN1KDM4EALDH1A1
SCHEMBL16116463 0.80 KDM4E (0.43) MAPTPOLBTDP1KMT2AKDM4E
SCHEMBL14734326 0.80 ALDH1A1 (0.41) MAPTPOLBTDP1KMT2AKDM4E
SCHEMBL20199621 0.78 DCTPP1 (0.54) MAPTPOLBKMT2AKDM4EALDH1A1
SCHEMBL30051141 0.78 DCTPP1 (0.54) MAPTPOLBKMT2AKDM4EALDH1A1
SCHEMBL25151263 0.78 KDM4E (0.45) MAPTKMT2AKDM4EALDH1A1LMNA
SCHEMBL30864205 0.76 TGFBR1 (0.59) MAPTPOLBKMT2AKDM4EALDH1A1
SCHEMBL30864206 0.76 TGFBR1 (0.59) MAPTPOLBKMT2AKDM4EALDH1A1
SCHEMBL20199384 0.76 MAPT (0.46) MAPTPOLBKMT2AKDM4EALDH1A1

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
CN-110225912-B GSK-3 inhibitors 百时美施贵宝公司 2022-10-21 CN disclosed
EP-3544980-B1 GSK-3 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-10-13 EP disclosed
EP-3544980-B1 GSK-3 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-10-13 EP disclosed
US-10774086-B2 GSK-3 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-09-15 US disclosed
US-10774086-B2 GSK-3 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-09-15 US disclosed
US-20190276463-A1 GSK-3 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-09-12 US disclosed
US-20190276463-A1 GSK-3 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-09-12 US disclosed
WO-2018098411-A1 GSK-3 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-31 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 (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-20190276463-A1 GSK-3 INHIBITORS GSK3B, GSK3A, GSKIP MAPT 81/4885POLB 1008/4885TDP1 1102/4885
US-10774086-B2 GSK-3 inhibitors GSK3B, GSK3A, GSKIP MAPT 81/4885POLB 1008/4885TDP1 1102/4885

“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.