SCHEMBL17201664

SCHEMBL17201664

COc1ccc(Cn2c(=O)c(C)c(-c3ccc(Oc4nccc5ccccc45)cc3C)n(C)c2=O)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 18/20 0.57
DRD5 P21918 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL17208473 0.90 DRD1 (0.58) DRD1DRD5
SCHEMBL16338221 0.82 DRD1 (0.58) DRD1SMN1; SMN2
SCHEMBL15667279 0.79 DRD1 (0.43) DRD1DRD5
SCHEMBL30362362 0.75 DRD1 (0.61) DRD1DRD5
SCHEMBL16337888 0.75 DRD1 (0.61) DRD1DRD5
SCHEMBL19479309 0.75 DRD1 (0.38) DRD1DRD5
SCHEMBL17201622 0.73 DRD1 (1.00) DRD1DRD5
SCHEMBL17200280 0.67 ESR1 (0.48) SMN1; SMN2ALDH1A1
SCHEMBL16335142 0.67 LMNA (0.39) SMN1; SMN2ALDH1A1
SCHEMBL16337648 0.67 DRD1 (0.61) DRD1DRD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9850232-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2017-12-26 US disclosed
US-9850232-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2017-12-26 US disclosed
US-9850232-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2017-12-26 US disclosed
US-9540352-B2 Substituted 1,7-naphthyridines as dopamine D1 ligands PFIZER INC. (US) 2017-01-10 US disclosed
US-9540352-B2 Substituted 1,7-naphthyridines as dopamine D1 ligands PFIZER INC. (US) 2017-01-10 US disclosed
US-9540352-B2 Substituted 1,7-naphthyridines as dopamine D1 ligands PFIZER INC. (US) 2017-01-10 US disclosed
US-20160200711-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2016-07-14 US disclosed
US-20160200711-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2016-07-14 US disclosed
US-20160200711-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2016-07-14 US disclosed
WO-2015162516-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2015-10-29 WO disclosed
US-20150307494-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2015-10-29 US disclosed
US-20150307494-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2015-10-29 US disclosed
US-20150307494-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2015-10-29 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-20160200711-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS DRD2, DRD1, DRD4 DRD1 2/4885DRD5 33/4885SMN1; SMN2 1446/4885
US-20150307494-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS DRD2, DRD1, DRD4 DRD1 2/4885DRD5 33/4885SMN1; SMN2 1446/4885

“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.