SCHEMBL22685704

SCHEMBL22685704

Cc1ccc(C)c([PH](=O)C(=O)c2c(Cl)cccc2Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
GAA P10253 3/20 0.37
POLB P06746 1/20 0.37
LMNA P02545 2/20 0.37
PBRM1 Q86U86 2/20 0.36
MAPT P10636 2/20 0.36
PTGS2 P35354 2/20 0.36
RAB9A P51151 3/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TYK2 P29597 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
ABCB1 P08183 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
FABP3 P05413 1/20 0.33
FABP4 P15090 1/20 0.33
CLCN2 P51788 1/20 0.33

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
SCHEMBL29902811 1.00 ALDH1A1 (0.38) ALDH1A1GAAPOLBLMNAPBRM1
SCHEMBL17424000 0.81 TDP1 (0.35) ALDH1A1GAALMNAKDM4EMEN1
SCHEMBL9355484 0.70 TDP1 (0.39) ALDH1A1GAALMNAMEN1KMT2A
SCHEMBL28528329 0.69 TP53 (0.36) ALDH1A1GAALMNAKDM4EMEN1
SCHEMBL10060108 0.69 ALDH1A1 (0.52) ALDH1A1GAAPOLBLMNAPBRM1
SCHEMBL10870076 0.69 ALDH1A1 (0.40) ALDH1A1GAAPOLBLMNAPBRM1
SCHEMBL27928549 0.69 CYP2A6 (0.46) ALDH1A1GAALMNAMAPTKDM4E
SCHEMBL27928534 0.69 ABCG2 (0.43) ALDH1A1POLBLMNAMAPTPTGS2
SCHEMBL8425238 0.68 ALDH1A1 (0.47) ALDH1A1GAAPOLBPBRM1MAPT
SCHEMBL28200325 0.68 LMNA (0.36) ALDH1A1LMNAKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200368117-A1 MICROCAPSULE WITH A POROUS OR HOLLOW CORE AND PH-SENSITIVE SHELL AND USE THEREOF SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2020-11-26 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-20200368117-A1 MICROCAPSULE WITH A POROUS OR HOLLOW CORE AND PH-SENSITIVE SHELL AND USE THEREOF HAMP, FECH, HAO2 ALDH1A1 2717/4885GAA 2225/4885POLB 3589/4885

“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.