SCHEMBL23327149

SCHEMBL23327149

O=C1C(c2cnc3ccccc3n2)=C(O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 1.00
HSP90AB1 P08238 2/20 1.00
NPC1 O15118 9/20 0.52
RAB9A P51151 8/20 0.52
MAPT P10636 7/20 0.52
SMN1; SMN2 Q16637 6/20 0.52
TP53 P04637 2/20 0.52
ESR1 P03372 1/20 0.52
PTK2B Q14289 1/20 0.52
BCHE P06276 1/20 0.49
ALDH1A1 P00352 6/20 0.47
MAPK10 P53779 3/20 0.47
HSD17B10 Q99714 3/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALOX12 P18054 1/20 0.46
ATM Q13315 1/20 0.46
KDM4E B2RXH2 3/20 0.45
APAF1 O14727 2/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL29918043 1.00 HSP90AA1 (1.00) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL11964734 0.79 HSP90AA1 (0.66) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL15106802 0.73 HSP90AA1 (0.58) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL2076567 0.73 HSP90AA1 (0.57) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL26655868 0.73 APAF1 (0.67) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL9797474 0.73 BCHE (0.58) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL29942654 0.71 NPC1 (0.63) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL29614829 0.71 NPC1 (0.63) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL29966674 0.71 NPC1 (0.63) HSP90AA1HSP90AB1NPC1RAB9AMAPT
SCHEMBL3076524 0.71 NPC1 (0.63) HSP90AA1HSP90AB1NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024933-A1 TREATMENT OF ABERRANT FIBROBLAST PROLIFERATION GEORG-AUGUST-UNIVERSITAET GOETTINGEN STIFTUNG OEFFENLICHEN RECHTS, UNIVERSITAETSMEDIZIN (DE) 2023-01-26 US disclosed
US-11331333-B2 Treatment of aberrant fibroblast proliferation Georg-August-Universität Göttingen Stiftung Öffentichen Rechts, Universitätsmadizin (DE) 2022-05-17 US disclosed
US-20210137963-A1 TREATMENT OF ABERRANT FIBROBLAST PROLIFERATION GEORG-AUGUST-UNIVERSITAET GOETTINGEN STIFTUNG OEFFENLICHEN RECHTS, UNIVERSITAETSMEDIZIN (DE) 2021-05-13 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 (3 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-20230024933-A1 TREATMENT OF ABERRANT FIBROBLAST PROLIFERATION EYA2, EYA3, PTP4A1 HSP90AA1 449/4885HSP90AB1 557/4885NPC1 4057/4885
US-20210137963-A1 TREATMENT OF ABERRANT FIBROBLAST PROLIFERATION EYA2, EYA3, PTP4A1 HSP90AA1 449/4885HSP90AB1 557/4885NPC1 4057/4885
US-11331333-B2 Treatment of aberrant fibroblast proliferation EYA2, EYA3, PTP4A1 HSP90AA1 449/4885HSP90AB1 557/4885NPC1 4057/4885

“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.