SCHEMBL19718136

SCHEMBL19718136

O=C(O)CCCCOc1cccc(-c2c3nc(c(-c4cccc(O)c4)c4ccc([nH]4)c(-c4cccc(O)c4)c4nc(c(-c5cccc(O)c5)c5ccc2[nH]5)C=C4)C=C3)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.51
▸ PPARA Q07869 1/20 0.51
▸ PDE2A O00408 2/20 0.44
▸ PDE3B Q13370 2/20 0.44
▸ PDE3A Q14432 2/20 0.44
▸ P2RY12 Q9H244 1/20 0.44
▸ HDAC3 O15379 4/20 0.43
▸ HDAC4 P56524 4/20 0.43
▸ HDAC1 Q13547 4/20 0.43
▸ HDAC7 Q8WUI4 4/20 0.43
▸ HDAC2 Q92769 4/20 0.43
▸ HDAC10 Q969S8 4/20 0.43
▸ HDAC11 Q96DB2 4/20 0.43
▸ HDAC8 Q9BY41 4/20 0.43
▸ HDAC6 Q9UBN7 4/20 0.43
▸ HDAC9 Q9UKV0 4/20 0.43
▸ HDAC5 Q9UQL6 4/20 0.43
▸ DHFR P00374 4/20 0.43
▸ CYSLTR2 Q9NS75 1/20 0.43
▸ CYSLTR1 Q9Y271 1/20 0.43

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
SCHEMBL29831938 1.00 PPARG (0.51) PPARGPPARAPDE2APDE3BPDE3A
SCHEMBL30293912 0.92 HDAC1 (0.43) PPARGPPARAPDE3BPDE3AP2RY12
SCHEMBL29831314 0.88 PPARG (0.52) PPARGPPARAPDE2APDE3BPDE3A
SCHEMBL19718153 0.88 PPARG (0.52) PPARGPPARAPDE2APDE3BPDE3A
SCHEMBL19718117 0.88 CYSLTR2 (0.47) PPARGPPARAPDE3BPDE3AP2RY12
SCHEMBL29831280 0.86 HDAC3 (0.37) PPARGPPARAHDAC3HDAC4HDAC1
SCHEMBL585409 0.85 TSHR (0.41) PPARGPPARA
SCHEMBL585553 0.85 TSHR (0.41) PPARGPPARA
SCHEMBL10084837 0.85 GPBAR1 (0.40) PPARGPPARAHDAC3HDAC4HDAC1
SCHEMBL15399779 0.81 TOP1 (0.49) PPARGPPARAPDE2APDE3BPDE3A

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-20230302144-A1 Porphyrin Compounds and Compositions Useful for Treating Cancer ONCOSELECT THERAPEUTICS, LLC (US) 2023-09-28 — — US disclosed
US-11590233-B2 Porphyrin compounds and compositions useful for treating cancer ONCOSELECT THERAPEUTICS, LLC (US) 2023-02-28 — — US disclosed
US-20190184021-A1 Porphyrin Compounds and Compositions Useful for Treating Cancer ONCOSELECT THERAPEUTICS, LLC 2019-06-20 — — US disclosed
EP-3471774-A1 PORPHYRIN COMPOUNDS AND COMPOSITIONS USEFUL FOR TREATING CANCER Oncoselect Therapeutics, LLC (US) 2019-04-24 — — EP disclosed
WO-2017218959-A1 PORPHYRIN COMPOUNDS AND COMPOSITIONS USEFUL FOR TREATING CANCER ONCOSELECT THERAPEUTICS, LLC (US) 2017-12-21 — — 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 (3 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-20230302144-A1 Porphyrin Compounds and Compositions Useful for Treating Cancer KIT, HCCS, PPIF PPARG 3665/4885PPARA 4448/4885PDE2A 3678/4885
US-11590233-B2 Porphyrin compounds and compositions useful for treating cancer KIT, HCCS, PPIF PPARG 3665/4885PPARA 4448/4885PDE2A 3678/4885
US-20190184021-A1 Porphyrin Compounds and Compositions Useful for Treating Cancer TK2, KIT, HCCS PPARG 3635/4885PPARA 4131/4885PDE2A 4043/4885

“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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