SCHEMBL118231

SCHEMBL118231

O=C(O)C1CCCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 2/20 0.46
FABP5 Q01469 2/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SLC6A1 P30531 2/20 0.45
TSHR P16473 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 4/20 0.42
HPGD P15428 2/20 0.42
CREBBP Q92793 1/20 0.42

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
SCHEMBL799721 1.00 FABP7 (0.46) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL29710361 1.00 FABP7 (0.46) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL29516735 1.00 FABP7 (0.46) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL29401030 1.00 FABP7 (0.46) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL4362743 1.00 FABP7 (0.46) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL800040 0.93 SMN1; SMN2 (0.53) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL29922193 0.93 SMN1; SMN2 (0.53) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL15884802 0.93 SMN1; SMN2 (0.53) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL1372951 0.89 TSHR (0.43) FABP7FABP5SMN1; SMN2NPC1RAB9A
SCHEMBL4359233 0.89 TSHR (0.43) FABP7FABP5SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515880-B1 METHODS AND COMPOSITIONS FOR SYNTHESIS OF ENCODED LIBRARIES HITGEN INC (CN) 2023-05-10 EP disclosed
US-20230082167-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC (US) 2023-03-16 US disclosed
CN-108698992-B 2-cyanoisoindoline derivatives for the treatment of cancer 特殊治疗有限公司 2022-04-19 CN disclosed
EP-3429994-B1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER MISSION THERAPEUTICS LTD (GB) 2021-06-16 EP disclosed
US-10689415-B2 Conjugates of RGD peptides and (bacterio)chlorophyll photosensitizers YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2020-06-23 US disclosed
US-10683269-B2 2-cyanoisoindoline derivatives for treating cancer MISSION THERAPEUTICS LIMITED (GB) 2020-06-16 US disclosed
US-10654834-B2 Non-systemic TGR5 agonists Venenum Biodesign, LLC (US) 2020-05-19 US disclosed
US-20190330191-A1 NOVEL NON-SYSTEMIC TGR5 AGONISTS Venenum Biodesign, LLC (US) 2019-10-31 US disclosed
EP-2061512-B1 CONJUGATES OF RGD PEPTIDES AND (BACTERIO)CHLOROPHYLL PHOTOSENSITIZERS AND THEIR USES YEDA RES & DEV (IL) 2019-10-02 EP disclosed
EP-3429994-A1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER Mission Therapeutics Limited (GB) 2019-01-23 EP disclosed
EP-0708765-A1 SUBSTITUTED PIPERAZINYLCAMPHOR DERIVATIVES AS OXYTOCIN ANTAGONISTS MERCK & CO. INC. (US) 1996-05-01 EP disclosed
CN-1119019-A Compositions and methods for treating immunomodulatory inflammation ARRIS PHARM CORP (US) 1996-03-20 CN disclosed
EP-0688337-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF IMMUNOMEDIATED INFLAMMATORY DISORDERS ARRIS PHARMACEUTICAL CORPORATION (US) 1995-12-27 EP disclosed
WO-1995002587-A1 SUBSTITUTED PIPERAZINYLCAMPHOR DERIVATIVES AS OXYTOCIN ANTAGONISTS MERCK & CO., INC. (US) 1995-01-26 WO disclosed
WO-1994020527-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF IMMUNOMEDIATED INFLAMMATORY DISORDERS ARRIS PHARMACEUTICAL CORPORATION (US) 1994-09-15 WO disclosed
US-5204349-A Treatment of preterm labor, dysmenorrhea and for stoppage of labor prior to cesarian delivery MERCK & CO., INC. (US) 1993-04-20 US disclosed
WO-1993006092-A1 PIPERAZINYL (SULFONYL)AMIDE DERIVATIVES OF CAMPHOR AS OXYTOCIN ANTAGONISTS MERCK & CO., INC. (US) 1993-04-01 WO disclosed
CN-1070399-A The amide derivatives oxytocin antagonist that piperizinylcamphorsuoxytocin replaces MERCK & CO INC (US) 1993-03-31 CN disclosed
EP-0533244-A1 Amide-substituted derivatives of spiroindanylcamphorsulfonyl oxytocin antagonists MERCK & CO. INC. (US) 1993-03-24 EP disclosed
EP-0532097-A1 Piperazinyl(sulfon)amide derivatives of camphor as oxytocin antagonists MERCK & CO. INC. (US) 1993-03-17 EP 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-10689415-B2 Conjugates of RGD peptides and (bacterio)chlorophyll photosensitizers MVD, AGER, FOLH1 FABP7 738/4885FABP5 855/4885SMN1; SMN2 4811/4885
US-20190330191-A1 NOVEL NON-SYSTEMIC TGR5 AGONISTS GPR119, FFAR1, FFAR3 FABP7 515/4885FABP5 54/4885SMN1; SMN2 3965/4885
US-10654834-B2 Non-systemic TGR5 agonists GPR119, SSTR5, FFAR3 FABP7 653/4885FABP5 75/4885SMN1; SMN2 3817/4885
US-10683269-B2 2-cyanoisoindoline derivatives for treating cancer USP7, USP47, USP2 FABP7 2979/4885FABP5 3195/4885SMN1; SMN2 4184/4885
US-20230082167-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 FABP7 4842/4885FABP5 4534/4885SMN1; SMN2 3236/4885

“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.