SCHEMBL18156768

SCHEMBL18156768

CCc1nc2ccccc2n1-c1ccc(-c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3-c3c2ccc2oc4ccccc4c32)cc1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.35
POLB P06746 1/20 0.35
RECQL P46063 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
RAB9A P51151 1/20 0.31
HKDC1 Q2TB90 1/20 0.31
PDE10A Q9Y233 3/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL18156765 0.87 ESR1 (0.37) RECQLALDH1A1MEN1MAPTKMT2A
SCHEMBL20224492 0.85 RECQL (0.36) RECQLALDH1A1SMN1; SMN2MEN1MAPT
SCHEMBL18314568 0.84 PSMD14 (0.34) PSMD14POLBRECQLL3MBTL1ALDH1A1
SCHEMBL23894908 0.81 PPARG (0.33) PDE10A
SCHEMBL24674258 0.80 KDM4E (0.36) POLBALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL24673735 0.80 KDM4E (0.36) POLBALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL19315574 0.80 ALDH1A1 (0.36) POLBL3MBTL1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL19315737 0.80 MEN1 (0.33) POLBALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL18156764 0.80 ESR1 (0.39) RECQLALDH1A1MEN1MAPTKMT2A
SCHEMBL20224493 0.80 SIRT2 (0.33) MEN1MAPTKMT2APDE10A

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-20230126850-A1 HETEROCYCLIC SPIRO COMPOUNDS MERCK PATENT GMBH (DE) 2023-04-27 US disclosed
US-20230126850-A1 HETEROCYCLIC SPIRO COMPOUNDS MERCK PATENT GMBH (DE) 2023-04-27 US disclosed
US-11545634-B2 Heterocyclic spiro compounds MERCK PATENT GMBH (DE) 2023-01-03 US disclosed
EP-3708634-A1 HETEROCYCLIC SPIRO COMPOUNDS Merck Patent GmbH (DE) 2020-09-16 EP disclosed
US-10777750-B2 Heterocyclic spiro compounds BASF SE (DE) 2020-09-15 US disclosed
US-20200266364-A1 HETEROCYCLIC SPIRO COMPOUNDS MERCK PATENT GMBH (DE) 2020-08-20 US disclosed
EP-3083880-B1 HETEROCYCLIC SPIRO COMPOUNDS MERCK PATENT GMBH (DE) 2020-04-01 EP disclosed
US-20160308147-A1 HETEROCYCLIC SPIRO COMPOUNDS MERCK PATENT GMBH (DE) 2016-10-20 US disclosed
US-20160308147-A1 HETEROCYCLIC SPIRO COMPOUNDS MERCK PATENT GMBH (DE) 2016-10-20 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 (5 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-20160308147-A1 HETEROCYCLIC SPIRO COMPOUNDS NES, KCNC1, HCN4 PSMD14 4642/4885POLB 3232/4885RECQL 1091/4885
US-11545634-B2 Heterocyclic spiro compounds NES, KCNC1, HCN4 PSMD14 4642/4885POLB 3232/4885RECQL 1091/4885
US-20200266364-A1 HETEROCYCLIC SPIRO COMPOUNDS NES, KCNC1, HCN4 PSMD14 4642/4885POLB 3232/4885RECQL 1091/4885
US-20230126850-A1 HETEROCYCLIC SPIRO COMPOUNDS NES, KCNC1, HCN4 PSMD14 4642/4885POLB 3232/4885RECQL 1091/4885
US-10777750-B2 Heterocyclic spiro compounds NES, KCNC1, HCN4 PSMD14 4642/4885POLB 3232/4885RECQL 1091/4885

“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.