SCHEMBL1106092

SCHEMBL1106092

CC(C)c1nocc1C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL21211721 0.81 NOTUM (0.32)
SCHEMBL23219565 0.80
SCHEMBL1106198 0.70 NPC1 (0.33) NPC1LMNATP53RAB9ASMN1; SMN2
SCHEMBL11941344 0.70 SMN1; SMN2 (0.33) NPC1LMNATP53RAB9ASMN1; SMN2
SCHEMBL4546373 0.70
SCHEMBL18857629 0.70 ALDH1A1 (0.33) NPC1LMNATP53RAB9ASMN1; SMN2
SCHEMBL22140412 0.68 NPC1 (0.32) NPC1LMNATP53RAB9ASMN1; SMN2
SCHEMBL22140330 0.68 NPC1 (0.36) NPC1LMNATP53RAB9ASMN1; SMN2
SCHEMBL22140356 0.68 NPC1 (0.32) NPC1LMNATP53RAB9ASMN1; SMN2
SCHEMBL12601238 0.68 ALDH1A1 (0.39) NPC1LMNATP53RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227437-A1 IMMUNOMODULATOR HITGEN INC (CN) 2023-07-20 US disclosed
US-20230227437-A1 IMMUNOMODULATOR HITGEN INC (CN) 2023-07-20 US disclosed
US-20230159465-A1 IMMUNOMODULATOR HITGEN INC. (CN) 2023-05-25 US disclosed
US-20230139111-A1 DIHYDRONAPHTHYRIDINONE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2023-05-04 US disclosed
US-11564930-B2 RIP1 inhibitory compounds and methods for making and using the same RIGEL PHARMACEUTICALS, INC. (US) 2023-01-31 US disclosed
US-20220235032-A1 BISHETEROCYCLIC CARBONYL SUBSTITUTED DIHYDROPYRAZOLE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2022-07-28 US disclosed
US-11370764-B2 RIP1 inhibitory compounds and methods for making and using the same RIGEL PHARMACEUTICALS INC. (US) 2022-06-28 US disclosed
US-20210069208-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. 2021-03-11 US disclosed
US-20210002236-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2021-01-07 US disclosed
US-20200247785-A1 IL-17 Ligands And Uses Thereof DICE MOLECULES SV, INC. 2020-08-06 US disclosed
US-20140213538-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. 2014-07-31 US disclosed
US-20140200215-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. 2014-07-17 US disclosed
US-20120157403-A1 BICYCLIC AND TRICYCLIC DERIVATIVES AS THROMBIN RECEPTOR ANTAGONISTS CHACKALAMANNIL SAMUEL (US) 2012-06-21 US disclosed
US-8153664-B2 thrombosis, atherosclerosis, restenosis, hypertension, angina pectoris, arrhythmia, heart failures and cancer SCHERING CORPORATION (US) 2012-04-10 US disclosed
US-20080090830-A1 Bicyclic And Tricyclic Derivatives As Thrombin Receptor Antagonists SCHERING CORPORATION 2008-04-17 US 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 (13 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-20080090830-A1 Bicyclic And Tricyclic Derivatives As Thrombin Receptor Antagonists EDNRB, TBXA2R, BDKRB1 NPC1 3306/4885LMNA 874/4885TP53 2498/4885
US-20140213538-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR5 NPC1 383/4885LMNA 701/4885TP53 4335/4885
US-20230139111-A1 DIHYDRONAPHTHYRIDINONE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF RIPK1, RIPK4, RIPK3 NPC1 1034/4885LMNA 1598/4885TP53 3635/4885
US-20230159465-A1 IMMUNOMODULATOR IL2, IL17A, IL2RA NPC1 1184/4885LMNA 4848/4885TP53 2107/4885
US-20230227437-A1 IMMUNOMODULATOR IL17A, IL2, IL2RA NPC1 1751/4885LMNA 4866/4885TP53 1955/4885
US-20200247785-A1 IL-17 Ligands And Uses Thereof IL17A, IL2, IL15 NPC1 3473/4885LMNA 3817/4885TP53 412/4885
US-20210002236-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIPK1, RIPK2, RIPK3 NPC1 976/4885LMNA 1539/4885TP53 776/4885
US-20140200215-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR5 NPC1 383/4885LMNA 701/4885TP53 4335/4885
US-20120157403-A1 BICYCLIC AND TRICYCLIC DERIVATIVES AS THROMBIN RECEPTOR ANTAGONISTS EDNRB, TBXA2R, BDKRB1 NPC1 3186/4885LMNA 1126/4885TP53 2433/4885
US-20210069208-A1 RIP1 INHIBITORY COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME RIPK1, RIPK2, RIPK3 NPC1 1013/4885LMNA 1595/4885TP53 789/4885
US-11564930-B2 RIP1 inhibitory compounds and methods for making and using the same RIPK1, RIPK2, RIPK3 NPC1 976/4885LMNA 1539/4885TP53 776/4885
US-20220235032-A1 BISHETEROCYCLIC CARBONYL SUBSTITUTED DIHYDROPYRAZOLE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF RIPK1, RIPK4, RIPK3 NPC1 1243/4885LMNA 1670/4885TP53 2163/4885
US-11370764-B2 RIP1 inhibitory compounds and methods for making and using the same RIPK1, RIPK2, RIPK3 NPC1 976/4885LMNA 1539/4885TP53 776/4885

“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.