SCHEMBL6324567

SCHEMBL6324567

Cc1sccc1-c1noc(CCC(=O)O)n1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.61
TSHR P16473 1/20 0.53
LMNA P02545 2/20 0.53
ATM Q13315 1/20 0.53
ALDH1A1 P00352 3/20 0.53
HPGD P15428 2/20 0.53
CYP3A4 P08684 1/20 0.53
TP53 P04637 2/20 0.51
MITF O75030 1/20 0.51
NCOA3 Q9Y6Q9 1/20 0.51
FFAR1 O14842 3/20 0.44
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
KLF5 Q13887 1/20 0.41

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
SCHEMBL6330969 0.85 MCL1 (0.58) MCL1TSHRLMNAATMALDH1A1
SCHEMBL27608351 0.85 MCL1 (0.58) MCL1TSHRLMNAATMALDH1A1
SCHEMBL6326180 0.78 HPGD (0.65) MCL1TSHRLMNAATMALDH1A1
SCHEMBL6325635 0.76 MCL1 (1.00) MCL1LMNAALDH1A1HPGDFFAR1
SCHEMBL1684613 0.75 TSHR (0.74) TSHRLMNAATMALDH1A1HPGD
SCHEMBL6326222 0.75 MCL1 (0.55) MCL1TSHRLMNAATMALDH1A1
SCHEMBL6325690 0.74 ALDH1A1 (0.67) MCL1TSHRLMNAATMALDH1A1
SCHEMBL6328228 0.73 ALDH1A1 (0.65) MCL1TSHRLMNAATMALDH1A1
SCHEMBL6324009 0.73 TSHR (0.56) MCL1TSHRLMNAATMALDH1A1
SCHEMBL6326021 0.73 ATM (0.72) MCL1TSHRLMNAATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423120-A4 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORP (US) 2005-12-28 EP disclosed
US-6924284-B2 PARP inhibitors ICOS CORPORATION (US) 2005-08-02 US disclosed
CN-1568187-A 2H-2,3-dinitrogen phenodiazine-1-ketone and using method thereof ICOS CORP (US) 2005-01-19 CN disclosed
EP-1423120-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2004-06-02 EP disclosed
US-20040087588-A1 Parp inhibitors ICOS CORPORATION 2004-05-06 US disclosed
WO-2003015785-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2003-02-27 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-20040087588-A1 Parp inhibitors PARP1, PARP2, PARP11 MCL1 379/4885TSHR 4656/4885LMNA 448/4885

“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.