SCHEMBL23631982

SCHEMBL23631982

O=C(O)c1ccc(N2CCC(Oc3ccc(C(F)(F)F)cc3)C2)cc1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 5/20 0.59
LIPC P11150 1/20 0.59
NOTUM Q6P988 1/20 0.56
EPHX2 P34913 1/20 0.53
ACACB O00763 9/20 0.51
LPL P06858 1/20 0.51
FFAR4 Q5NUL3 3/20 0.48
ADRB2 P07550 1/20 0.47

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
SCHEMBL23631980 1.00 LIPG (0.59) LIPGLIPCNOTUMEPHX2ACACB
SCHEMBL23632266 1.00 LIPG (0.59) LIPGLIPCNOTUMEPHX2ACACB
SCHEMBL28577830 0.93 FFAR4 (0.53) LIPGLIPCNOTUMEPHX2FFAR4
SCHEMBL28584607 0.93 FFAR4 (0.53) LIPGLIPCNOTUMEPHX2FFAR4
SCHEMBL28577831 0.93 FFAR4 (0.53) LIPGLIPCNOTUMEPHX2FFAR4
SCHEMBL23632079 0.90 LIPG (0.56) LIPGLIPCNOTUMEPHX2ACACB
SCHEMBL30065043 0.87 ACACB (0.53) LIPGLIPCNOTUMACACB
SCHEMBL30065058 0.87 ACACB (0.53) LIPGLIPCNOTUMACACB
SCHEMBL23632624 0.83 LIPG (0.68) LIPGLIPCACACBLPL
SCHEMBL23632453 0.83 LIPG (0.65) LIPGLIPCNOTUMACACBLPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113072476-B ROR gamma t inhibitor and preparation method and application thereof 广东东阳光药业股份有限公司 2024-05-14 CN disclosed
CN-113072542-B ROR gamma t inhibitor and preparation method and application thereof 广东东阳光药业股份有限公司 2024-04-05 CN disclosed
US-20230121086-A1 RORgT INHIBITOR, PREPARATION METHOD THEREOF AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2023-04-20 US disclosed
US-20230067159-A1 ROR-GAMMA-T INHIBITOR, PREPARATION METHOD THEREOF AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2023-03-02 US disclosed
EP-4089079-A1 ROR GAMMA T INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2022-11-16 EP disclosed
EP-4089080-A1 RORyT INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2022-11-16 EP disclosed
WO-2021139595-A1 RORγT INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 东莞市东阳光新药研发有限公司 2021-07-15 WO disclosed
WO-2021139599-A1 RORγT INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 东莞市东阳光新药研发有限公司 2021-07-15 WO disclosed
CN-113072476-A ROR gamma t inhibitor and preparation method and application thereof 广东东阳光药业有限公司 2021-07-06 CN disclosed
CN-113072542-A ROR gamma t inhibitor and preparation method and application thereof 广东东阳光药业有限公司 2021-07-06 CN 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 (2 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-20230067159-A1 ROR-GAMMA-T INHIBITOR, PREPARATION METHOD THEREOF AND USE THEREOF RORC, RORB, RORA LIPG 3910/4885LIPC 1905/4885NOTUM 1733/4885
US-20230121086-A1 RORgT INHIBITOR, PREPARATION METHOD THEREOF AND USE THEREOF RORC, RORB, RORA LIPG 2587/4885LIPC 2117/4885NOTUM 1971/4885

“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.