SCHEMBL27219489

SCHEMBL27219489

O=C(c1ccccc1)c1ccc(C2CCCCC2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.48
▸ ELANE P08246 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ HAO1 Q9UJM8 1/20 0.44
▸ ALDH1A1 P00352 6/20 0.44
▸ MAPT P10636 3/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ SRD5A2 P31213 2/20 0.43
▸ LMNA P02545 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ STAT1 P42224 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ MEN1 O00255 1/20 0.40

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
SCHEMBL27219399 0.85 MCL1 (0.47) MCL1KDM4EHAO1ALDH1A1MAPT
SCHEMBL15883736 0.85 MCL1 (0.47) MCL1KDM4EHAO1ALDH1A1MAPT
Hydrogen Peroxide SCHEMBL14842506 0.85 MCL1 (0.53) MCL1KDM4EALDH1A1MAPTL3MBTL1
SCHEMBL190786 0.83 SLC18A3 (0.51) MCL1KDM4EMAPTL3MBTL1TP53
SCHEMBL15874652 0.83 SLC18A3 (0.51) MCL1KDM4EMAPTL3MBTL1TP53
SCHEMBL9328018 0.83 SLC18A3 (0.51) MCL1KDM4EMAPTL3MBTL1TP53
SCHEMBL15660493 0.81 SLC18A3 (0.50) MCL1KDM4EMAPTL3MBTL1TP53
SCHEMBL4063122 0.81 SLC18A3 (0.50) MCL1KDM4EMAPTL3MBTL1TP53
SCHEMBL28417815 0.81 SLC18A3 (0.50) MCL1KDM4EMAPTL3MBTL1TP53
SCHEMBL15874614 0.81 SLC18A3 (0.50) MCL1KDM4EMAPTL3MBTL1TP53

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-20240158340-A1 PHOTOCATALYTIC ARYLATION OF CARBONYL COMPOUNDS AND METHODS FOR USING THE SAME ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2024-05-16 — — US disclosed
WO-2022235875-A1 PHOTOCATALYTIC ARYLATION OF CARBONYL COMPOUNDS AND METHODS FOR USING THE SαAME ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2022-11-10 — — 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 (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-20240158340-A1 PHOTOCATALYTIC ARYLATION OF CARBONYL COMPOUNDS AND METHODS FOR USING THE SAME AHR, CBR3, AADAC MCL1 2390/4885KDM4E 1512/4885ELANE 1678/4885

“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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