SCHEMBL5595265

SCHEMBL5595265

CC(C)c1ccc(N)c(O)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.69
ALDH1A1 P00352 3/20 0.69
ALOX12 P18054 2/20 0.69
HTT P42858 2/20 0.69
HIF1A Q16665 2/20 0.69
TRPA1 O75762 1/20 0.59
PTGS1 P23219 1/20 0.59
CACNA1C Q13936 1/20 0.59
TYR P14679 3/20 0.52
ALOX15 P16050 4/20 0.50
HSD17B10 Q99714 3/20 0.50
CYP3A4 P08684 2/20 0.50
RNASEH1 O60930 1/20 0.48
HPGD P15428 2/20 0.46
USP2 O75604 1/20 0.46
PKM P14618 1/20 0.46
KDM4E B2RXH2 6/20 0.45
MAPT P10636 5/20 0.45
POLB P06746 2/20 0.45
KMT2A Q03164 2/20 0.45

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
SCHEMBL30659005 1.00 GAA (0.69) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL5673396 0.86 GAA (0.52) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL27533485 0.82 ALOX15 (0.50) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL1025312 0.82 ALDH1A1 (1.00) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL6422982 0.79 ALOX15 (0.52) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL339292 0.78 TRPA1 (0.67) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL741007 0.78 ALDH1A1 (0.64) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL29549360 0.78 ALDH1A1 (0.64) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL29362968 0.78 TRPA1 (0.67) GAAALDH1A1ALOX12HTTHIF1A
SCHEMBL172232 0.78 TRPA1 (0.67) GAAALDH1A1ALOX12HTTHIF1A

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260022122-A1 NOVEL COMPOUND FOR INHIBITING NAMPT, AND COMPOSITION INCLUDING SAME CHECKMATE THERAPEUTICS INC. (KR) 2026-01-22 US disclosed
US-20240409533-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2024-12-12 US disclosed
CN-113874074-B HMOX1 inducers 米托布里奇公司 2024-11-01 CN disclosed
US-12071433-B2 HMOX1 inducers Astellas Engineered Small Molecules US, Incorporated (US) 2024-08-27 US disclosed
US-20240051952-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2024-02-15 US disclosed
CN-112313222-B Tetrahydroisoquinoline derivative, preparation method and application thereof 浙江海正药业股份有限公司 2024-01-26 CN disclosed
WO-2023229346-A1 NOVEL COMPOUND FOR INHIBITING NAMPT, AND COMPOSITION INCLUDING SAME 주식회사 체크메이트테라퓨틱스 2023-11-30 WO disclosed
US-20230158155-A1 Cell Surface Receptor Binding Compounds and Conjugates LYCIA THERAPEUTICS, INC. 2023-05-25 US disclosed
US-11384097-B2 Tetrahydroisoquinoline derivative, preparation method therefor and use thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2022-07-12 US disclosed
US-11384097-B2 Tetrahydroisoquinoline derivative, preparation method therefor and use thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2022-07-12 US disclosed
US-6180675-B1 THERAPY FOR CHEMOKINE SENSITIVE DISEASE; USING A AROMATIC (THIO)UREA COMPOUND SMITHKLINE BEECHAM CORPORATION 2001-01-30 US disclosed
WO-2000076495-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2000-12-21 WO disclosed
US-6005008-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-12-21 US disclosed
CN-1215990-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORP (US) 1999-05-05 CN disclosed
US-5886044-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1999-03-23 US disclosed
EP-0896531-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-02-17 EP disclosed
US-5780483-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1998-07-14 US disclosed
EP-0809492-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-12-03 EP disclosed
WO-1997029743-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-08-21 WO disclosed
WO-1996025157-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1996-08-22 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 (6 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-11384097-B2 Tetrahydroisoquinoline derivative, preparation method therefor and use thereof AGTR2, AGTR1, AVPR2 GAA 4049/4885ALDH1A1 1576/4885ALOX12 1527/4885
US-20230158155-A1 Cell Surface Receptor Binding Compounds and Conjugates M6PR, ASGR1, IGF2R GAA 83/4885ALDH1A1 3655/4885ALOX12 3322/4885
US-20240409533-A1 HMOX1 INDUCERS HMOX1, HMOX2, HMBS GAA 2202/4885ALDH1A1 332/4885ALOX12 7/4885
US-12071433-B2 HMOX1 inducers HMOX1, HMOX2, HMBS GAA 2123/4885ALDH1A1 223/4885ALOX12 7/4885
US-20240051952-A1 HMOX1 INDUCERS HMOX1, HMOX2, QSOX1 GAA 1965/4885ALDH1A1 266/4885ALOX12 6/4885
US-20260022122-A1 NOVEL COMPOUND FOR INHIBITING NAMPT, AND COMPOSITION INCLUDING SAME NAMPT, NAPRT, NNT GAA 2409/4885ALDH1A1 789/4885ALOX12 2306/4885

“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.