SCHEMBL855857

SCHEMBL855857

C=CC1CCCCC(=O)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.38
TRIM33 Q9UPN9 2/20 0.38
ALDH1A1 P00352 1/20 0.36
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
NOS3 P29474 2/20 0.32
NOS1 P29475 2/20 0.32
NOS2 P35228 2/20 0.32
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.30

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
SCHEMBL855856 1.00 TRIM24 (0.38) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL23687397 0.93
SCHEMBL857656 0.93
SCHEMBL725114 0.93
SCHEMBL18922082 0.86
SCHEMBL2068452 0.86
SCHEMBL20049585 0.86
SCHEMBL7947709 0.80 TRIM24 (0.39) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL7942803 0.78 TRIM24 (0.42) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL2068418 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12053451-B2 Arginase inhibitors and their therapeutic applications Oncoarendi Therapeutics S.A. (PL) 2024-08-06 US disclosed
EP-3852747-B1 CYCLOHEPTYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2023-05-31 EP disclosed
EP-3852747-B1 CYCLOHEPTYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2023-05-31 EP disclosed
US-20220041572-A1 CYCLOHEPTYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2022-02-10 US disclosed
CN-109415387-B Arginase inhibitors and therapeutic uses thereof 昂科艾伦迪治疗法公司 2021-08-27 CN disclosed
EP-3852747-A1 CYCLOHEPTYL ACIDS AS LPA ANTAGONISTS Bristol-Myers Squibb Company (US) 2021-07-28 EP disclosed
CN-112702998-A Cycloheptanoic acids as LPA antagonists 百时美施贵宝公司 2021-04-23 CN disclosed
US-10912755-B2 Arginase inhibitors and their therapeutic applications Oncoarendi Therapeutics S.A. (PL) 2021-02-09 US disclosed
US-10912755-B2 Arginase inhibitors and their therapeutic applications Oncoarendi Therapeutics S.A. (PL) 2021-02-09 US disclosed
EP-3452485-B1 ARGINASE INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS ONCOARENDI THERAPEUTICS SA (PL) 2020-09-09 EP disclosed
WO-2017191130-A2 ARGINASE INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS ONCOARENDI THERAPEUTICS SA (PL) 2017-11-09 WO disclosed
WO-2017191130-A2 ARGINASE INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS ONCOARENDI THERAPEUTICS SA (PL) 2017-11-09 WO disclosed
US-20140107100-A1 Benzoxazepines as Inhibitors of PI3K/mTOR and Methods of Their Use and Manufacture EXELIXIS, INC. (US) 2014-04-17 US disclosed
US-20140080810-A1 Benzoxazepines as Inhibitors of PI3K/mTOR and Methods of Their Use and Manufacture EXELIXIS, INC. (US) 2014-03-20 US disclosed
US-8648066-B2 Benzoxazepines as inhibitors of PI3K/mTOR and methods of their use and manufacture EXELIXIS, INC. (US) 2014-02-11 US disclosed
EP-2640366-A2 BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE Exelixis, Inc. (US) 2013-09-25 EP disclosed
WO-2012068096-A2 BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE EXELIXIS, INC. (US) 2012-05-24 WO disclosed
EP-2432779-A1 BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES Exelixis, Inc. (US) 2012-03-28 EP disclosed
US-20100298290-A1 Benzoxazepines as Inhibitors of PI3K/mTOR and Methods of Their Use and Manufacture EXELIXIS, INC. (US) 2010-11-25 US disclosed
WO-2010135524-A1 BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES EXELIXIS, INC. (US) 2010-11-25 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-20100298290-A1 Benzoxazepines as Inhibitors of PI3K/mTOR and Methods of Their Use and Manufacture MTOR, RICTOR, PIK3CA TRIM24 4023/4885TRIM33 4743/4885ALDH1A1 3395/4885
US-20220041572-A1 CYCLOHEPTYL ACIDS AS LPA ANTAGONISTS LPAR1, LPAR2, LPAR5 TRIM24 4226/4885TRIM33 4745/4885ALDH1A1 1734/4885
US-20140107100-A1 Benzoxazepines as Inhibitors of PI3K/mTOR and Methods of Their Use and Manufacture MTOR, RICTOR, PIK3CA TRIM24 4097/4885TRIM33 4793/4885ALDH1A1 3533/4885
US-20140080810-A1 Benzoxazepines as Inhibitors of PI3K/mTOR and Methods of Their Use and Manufacture MTOR, RICTOR, PIK3CA TRIM24 3963/4885TRIM33 4734/4885ALDH1A1 3049/4885
US-10912755-B2 Arginase inhibitors and their therapeutic applications ARG1, ARG2, ARGLU1 TRIM24 2896/4885TRIM33 2610/4885ALDH1A1 675/4885
US-12053451-B2 Arginase inhibitors and their therapeutic applications ARG1, ARG2, ARGLU1 TRIM24 2896/4885TRIM33 2610/4885ALDH1A1 675/4885

“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.