SCHEMBL5514384

SCHEMBL5514384

COCCn1c(COc2ccc(-c3nn(C)cc3-c3ccncc3)cc2)nc2ccccc21

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 14/20 0.64
TSHR P16473 2/20 0.62
RAB9A P51151 2/20 0.62
NPC1 O15118 1/20 0.61
TP53 P04637 1/20 0.61
KMT2A Q03164 1/20 0.61
LGALS3 P17931 1/20 0.61
PDE4D Q08499 1/20 0.61
PDE4A P27815 7/20 0.59
PDE4B Q07343 7/20 0.59
PDE3B Q13370 6/20 0.59
PDE3A Q14432 5/20 0.58

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
SCHEMBL30123242 1.00 PDE10A (0.64) PDE10ATSHRRAB9ANPC1TP53
SCHEMBL5526899 0.89 PDE10A (0.66) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL30123130 0.87 PDE10A (0.76) PDE10ARAB9ANPC1LGALS3PDE4D
SCHEMBL4724444 0.87 PDE10A (0.76) PDE10ARAB9ANPC1LGALS3PDE4D
SCHEMBL5530549 0.86 PDE10A (0.63) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL5520218 0.83 PDE10A (0.66) PDE10AKMT2ALGALS3PDE4DPDE4A
SCHEMBL5525694 0.82 PDE10A (0.64) PDE10ALGALS3PDE4DPDE4APDE4B
SCHEMBL4154400 0.80 PDE10A (0.68) PDE10ARAB9ANPC1TP53KMT2A
SCHEMBL17088233 0.78 PDE10A (1.00) PDE10ATSHRLGALS3PDE4DPDE4A
SCHEMBL17088238 0.78 PDE10A (1.00) PDE10ATSHRLGALS3PDE4DPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155779-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER INC 2007-07-05 US claimed
EP-4103161-B1 COMPOSITIONS AND USES THEREOF BENEVOLENTAI CAMBRIDGE LTD (GB) 2023-12-20 EP disclosed
US-20230149385-A1 COMPOSITIONS AND USES THEREOF Benevolentai Cambridge Limited (GB) 2023-05-18 US disclosed
WO-2007077490-A2 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER PRODUCTS INC. (US) 2007-07-12 WO disclosed
US-20070155779-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER INC 2007-07-05 US disclosed
US-20070155779-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER INC 2007-07-05 US disclosed
US-20070155779-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PFIZER INC 2007-07-05 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-20230149385-A1 COMPOSITIONS AND USES THEREOF PDE2A, PDE3A, PDE3B PDE10A 5/4885TSHR 4841/4885RAB9A 1032/4885
US-20070155779-A1 BICYCLIC HETEROARYL COMPOUNDS AS PDE10 INHIBITORS PDE12, PDE10A, PDE7A PDE10A 2/4885TSHR 3823/4885RAB9A 334/4885

“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.