SCHEMBL16723484

SCHEMBL16723484

COCOc1cc2oc(=O)c(C)cc2cc1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 3/20 0.41
HSD17B3 P37058 1/20 0.41
MAOB P27338 7/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
FHIT P49789 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36
NCOA1 Q15788 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ACHE P22303 1/20 0.35
MAOA P21397 1/20 0.34

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
SCHEMBL19147152 0.84 GPR35 (0.41) GPR35MAOBALDH1A1TSHRPPARG
SCHEMBL16722825 0.82 GPR35 (0.39) GPR35MAOBCA12CA1CA2
SCHEMBL29625894 0.78 MCL1 (0.55) MAOBCA12CA1CA2CA4
SCHEMBL22323948 0.73 PTGS1 (0.40) FHITALDH1A1TSHRSMN1; SMN2ACHE
SCHEMBL28374261 0.73 MCL1 (0.55) HSD17B3MAOBCA12CA1CA7
SCHEMBL29509339 0.72 LMNA (0.50) ALDH1A1SMN1; SMN2
SCHEMBL28686553 0.72 LMNA (0.50) ALDH1A1SMN1; SMN2
SCHEMBL15980355 0.72 HTR2A (0.39) ALDH1A1
SCHEMBL9900954 0.71 CNR2 (0.48) CA12CA1CA2ALDH1A1MAOA
SCHEMBL25696572 0.71 MAOB (0.58) MAOBCA12CA2CA4CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9593197-B2 Trigger-responsive chain-shattering polymers THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-03-14 US disclosed
US-20150141453-A1 Trigger-Responsive Chain-Shattering Polymers THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2015-05-21 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 (1 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-20150141453-A1 Trigger-Responsive Chain-Shattering Polymers SGTA, FUS, EWSR1 GPR35 2876/4885HSD17B3 3497/4885MAOB 3617/4885

“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.