SCHEMBL22601563

SCHEMBL22601563

CNc1ccnc(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.49
LMNA P02545 6/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
ALDH1A1 P00352 3/20 0.41
HTT P42858 2/20 0.39
HDAC4 P56524 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
CHRM1 P11229 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36

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
SCHEMBL9234478 0.82 SMARCA2 (0.51) HDAC4HDAC6SMARCA2SMARCA4IDH1
SCHEMBL30016319 0.82 SMARCA2 (0.51) HDAC4HDAC6SMARCA2SMARCA4IDH1
SCHEMBL22545167 0.80 JAK2 (0.37) PRKCIIDH1IDH2
SCHEMBL6544405 0.76 PRKCI (0.61) PRKCILMNASMN1; SMN2NPC1RAB9A
SCHEMBL13842708 0.76 PRKCI (0.61) PRKCILMNASMN1; SMN2NPC1RAB9A
SCHEMBL13015661 0.74 PRKCI (0.59) PRKCILMNASMN1; SMN2NPC1RAB9A
SCHEMBL17562223 0.74 PRKCI (0.41) PRKCILMNASMN1; SMN2NPC1RAB9A
SCHEMBL24506584 0.73 KDM4E (0.43) PRKCILMNASMN1; SMN2NPC1RAB9A
SCHEMBL27099645 0.73 PRKCI (0.32) PRKCILMNASMN1; SMN2NPC1RAB9A
SCHEMBL14063607 0.73 MAPT (0.41) LMNASMN1; SMN2NPC1RAB9ASYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912682-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
US-11912682-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
US-20230348418-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2023-11-02 US disclosed
US-20230348418-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2023-11-02 US disclosed
WO-2022051326-A1 LZK‑TARGETING DEGRADERS AND METHODS OF USE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-03-10 WO disclosed
WO-2021032209-A1 ANTI-INFLUENZA VIRUS COMPOUND, PREPARATION METHOD AND USE THEREOF 四川海思科制药有限公司 2021-02-25 WO disclosed
US-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 HEPAGENE THERAPEUTICS, INC. (VG) 2020-10-29 US disclosed
US-20160303110-A1 METHODS OF TREATING ABNORMAL MUSCULAR ACTIVITY AUSPEX PHARMACEUTICALS, INC. (US) 2016-10-20 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 (4 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-20230348418-A1 ISOINDOLINONE COMPOUNDS CYP4F2, AOC2, AOC3 PRKCI 2340/4885LMNA 1259/4885SMN1; SMN2 3260/4885
US-11912682-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 PRKCI 2386/4885LMNA 1164/4885SMN1; SMN2 3197/4885
US-20160303110-A1 METHODS OF TREATING ABNORMAL MUSCULAR ACTIVITY PYGM, TNNC1, MUSK PRKCI 820/4885LMNA 645/4885SMN1; SMN2 20/4885
US-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 ATF1, ERN1, MAP3K1 PRKCI 205/4885LMNA 3233/4885SMN1; SMN2 3406/4885

“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.