SCHEMBL22501677

SCHEMBL22501677

Cc1cc(=O)oc2cc(C(F)(F)F)ccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA9 Q16790 6/20 0.69
▸ CA1 P00915 4/20 0.69
▸ CA2 P00918 3/20 0.69
▸ CA5A P35218 2/20 0.69
▸ ALDH1A1 P00352 9/20 0.58
▸ KDM4E B2RXH2 7/20 0.58
▸ HPGD P15428 6/20 0.58
▸ HSD17B10 Q99714 6/20 0.58
▸ GLA P06280 4/20 0.58
▸ GAA P10253 4/20 0.58
▸ CASP1 P29466 3/20 0.58
▸ CASP7 P55210 3/20 0.58
▸ CA12 O43570 3/20 0.58
▸ LMNA P02545 2/20 0.58
▸ AKR1B1 P15121 2/20 0.58
▸ MCL1 Q07820 2/20 0.58
▸ CYP1A2 P05177 1/20 0.58
▸ CYP2C9 P11712 1/20 0.58
▸ UGT1A1 P22309 1/20 0.58
▸ MAOB P27338 1/20 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
SCHEMBL1102259 0.85 CA9 (0.62) CA9CA1CA2CA5AALDH1A1
SCHEMBL15842662 0.81 HSD17B3 (0.69) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL26628213 0.80 CA1 (0.47) CA9CA1CA2CA5AALDH1A1
SCHEMBL10712539 0.78 ALDH1A1 (0.56) CA9CA1CA2CA5AALDH1A1
SCHEMBL15842777 0.78 HSD17B3 (0.55) CA9CA1CA2CA5AALDH1A1
SCHEMBL19194216 0.77 ALDH1A1 (0.64) CA9CA1CA2CA5AALDH1A1
SCHEMBL724134 0.77 ALDH1A1 (0.68) CA9CA1CA2CA5AALDH1A1
Hymecromone SCHEMBL5499316 0.76 HSD17B3 (0.83) CA9CA1CA2CA5AALDH1A1
Hydrochloric Acid SCHEMBL30117164 0.75 ALDH1A1 (0.66) CA9CA1CA2CA5AALDH1A1
SCHEMBL30424058 0.75 ALDH1A1 (0.66) CA9CA1CA2CA5AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11945806-B2 Stabilization of amyloidogenic immunoglobulin light chains THE SCRIPPS RESEARCH INSTITUTE 2024-04-02 — — US disclosed
US-20220204485-A1 STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS THE SCRIPPS RESEARCH INSTITUTE 2022-06-30 — — US disclosed
US-20220204485-A1 STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS THE SCRIPPS RESEARCH INSTITUTE 2022-06-30 — — US disclosed
EP-3946604-A1 BENZOPYRANE AND IMIDAZOLE DERIVATIVES USEFUL FOR THE STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS The Scripps Research Institute (US) 2022-02-09 — — EP disclosed
WO-2020205683-A1 BENZOPYRANE AND IMIDAZOLE DERIVATIVES USEFUL FOR THE STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS THE SCRIPPS RESEARCH INSTITUTE (US) 2020-10-08 — — WO 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-20220204485-A1 STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS TTR, MAP1LC3B, SAAL1 CA9 4361/4885CA1 3942/4885CA2 4180/4885
US-11945806-B2 Stabilization of amyloidogenic immunoglobulin light chains TTR, MAP1LC3B, SAAL1 CA9 4361/4885CA1 3942/4885CA2 4180/4885

“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.

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