SCHEMBL4698367

SCHEMBL4698367

Cc1c(C=O)cccc1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 13/20 0.48
CD274 Q9NZQ7 13/20 0.48
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
THRB P10828 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KCNJ1 P48048 1/20 0.42
XDH P47989 1/20 0.39
TRIM24 O15164 1/20 0.39
TRIM33 Q9UPN9 1/20 0.39

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
SCHEMBL31499183 1.00 PDCD1 (0.48) PDCD1CD274ALDH1A1TSHRMEN1
SCHEMBL19897782 0.85 ALDH1A1 (0.52) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL30395616 0.85 ALDH1A1 (0.52) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL27539947 0.84 ALDH1A1 (0.43) PDCD1CD274ALDH1A1TSHRMEN1
SCHEMBL6979126 0.84 KCNJ1 (0.46) PDCD1CD274ALDH1A1TSHRMEN1
SCHEMBL27681523 0.83 ALDH1A1 (0.53) PDCD1CD274ALDH1A1TSHRMEN1
SCHEMBL18367731 0.83 ERN1 (0.41) PDCD1CD274ALDH1A1TSHRMEN1
SCHEMBL31620987 0.81 PDCD1 (0.51) PDCD1CD274
SCHEMBL5711323 0.81 LMNA (0.57) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL96494 0.81 LMNA (0.57) ALDH1A1TSHRMEN1LMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107011123-A A kind of method of catalytic hydrogen reduction 2-methyl-3-biphenylmethanol 江苏科菲特生化技术股份有限公司 2017-08-04 CN claimed
CN-101704723-B Preparation method of hydroxymethyl substitutent o-alkyl biphenyl and intermediate thereof SHANGHAI WANSU CHEMICAL CO LTD 2013-04-24 CN claimed
CN-101704723-A Preparation method of hydroxymethyl substitutent o-alkyl biphenyl and intermediate thereof SHANGHAI WANSU CHEMICAL CO LTD 2010-05-12 CN claimed
US-20250325660-A1 IMMUNOMODULATOR COMPOUNDS AND METHODS OF USE INCYTE CORP (US) 2025-10-23 US disclosed
CN-119136802-A Adenosine 2A receptor modulators for the treatment of cancer 瑞士日内瓦大学 2024-12-13 CN disclosed
CN-116768779-B Small molecular compound as immunomodulator, and composition and application thereof 齐鲁师范学院 2024-04-02 CN disclosed
CN-116874405-B Indole compound as immunomodulator and preparation method and application thereof 山东轩硕医药科技有限公司 2024-02-20 CN disclosed
EP-3615514-B1 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF AVIARA PHARMACEUTICALS INC (US) 2023-11-22 EP disclosed
US-20230331675-A1 AROMATIC ETHYLENE COMPOUND AND PREPARATION METHOD THEREFOR, AND INTERMEDIATE, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF GUANGZHOU MAXINOVEL PHARMACEUTICALS CO., LTD. (CN) 2023-10-19 US disclosed
US-20230331675-A1 AROMATIC ETHYLENE COMPOUND AND PREPARATION METHOD THEREFOR, AND INTERMEDIATE, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF GUANGZHOU MAXINOVEL PHARMACEUTICALS CO., LTD. (CN) 2023-10-19 US disclosed
CN-116874405-A Indole compound as immunomodulator and preparation method and application thereof 山东轩硕医药科技有限公司 2023-10-13 CN disclosed
US-6831193-B2 Treating pain, urinary incontinence and bladder overactivity; P2X receptors are cation-permeable ion channels ABBOTT LABORATORIES 2004-12-14 US disclosed
EP-1392643-A2 TRISUBSTITUTED-N- (1S)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENYL] BENZAMIDES WHICH INHIBIT P2X3 AND P2X2/3 CONTAINING RECEPTORS Abbott Laboratories (US) 2004-03-03 EP disclosed
US-20030083361-A1 Naphtho(1,2-d)imidazole derivatives; treating thrombocytopenia SMITHKLINE BEECHAM CORPORATION 2003-05-01 US disclosed
US-20030083359-A1 Trisubstituted-N-[(1S)-1,2,3,4-terrahydro-1-naphthalenyl]benzamides which inhibit P2X2/3 containing receptors ABBVIE INC. 2003-05-01 US disclosed
WO-2002094767-A2 TRISUBSTITUTED-N-[(1S)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENYL] BENZAMIDES WHICH INHIBIT P2X3 AND P2X2/3 CONTAINING RECEPTORS ABBOTT LABORATORIES (US) 2002-11-28 WO disclosed
US-20020173665-A1 Trisubstituted-N-[(1S)-1,2,3,4-tetrahydro-1-naphthalenyl] benzamides which inhibit P2X3 and P2X2/3 containing receptors ABBOTT LABORATORIES 2002-11-21 US disclosed
EP-0674620-A1 TRYPTAMINE ANALOGUES AS 5-HT 1?-LIKE AGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-10-04 EP disclosed
CN-1092765-A New tryptamine analogues and preparation method thereof and purposes SMITHKLINE BEECHAM PLC (GB) 1994-09-28 CN disclosed
WO-1994014771-A1 TRYPTAMINE ANALOGUES AS 5-HT1-LIKE AGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-07-07 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 (5 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-20020173665-A1 Trisubstituted-N-[(1S)-1,2,3,4-tetrahydro-1-naphthalenyl] benzamides which inhibit P2X3 and P2X2/3 containing receptors P2RX3, P2RX1, P2RX2 PDCD1 3505/4885CD274 3696/4885ALDH1A1 404/4885
US-20030083361-A1 Naphtho(1,2-d)imidazole derivatives; treating thrombocytopenia MPL, THPO, TPO PDCD1 384/4885CD274 216/4885ALDH1A1 2193/4885
US-20250325660-A1 IMMUNOMODULATOR COMPOUNDS AND METHODS OF USE CD274, PDCD1LG2, PDCD1 PDCD1 3/4885CD274 1/4885ALDH1A1 1759/4885
US-20030083359-A1 Trisubstituted-N-[(1S)-1,2,3,4-terrahydro-1-naphthalenyl]benzamides which inhibit P2X2/3 containing receptors P2RX3, P2RX1, P2RX2 PDCD1 3344/4885CD274 3316/4885ALDH1A1 392/4885
US-20230331675-A1 AROMATIC ETHYLENE COMPOUND AND PREPARATION METHOD THEREFOR, AND INTERMEDIATE, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF PDCD1, CD274, PDCD1LG2 PDCD1 1/4885CD274 2/4885ALDH1A1 243/4885

“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.