SCHEMBL10052292

SCHEMBL10052292

CC(C)CCN1CCC(CC(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.37
ARG2 P78540 1/20 0.37
CHRM4 P08173 2/20 0.36
SIGMAR1 Q99720 4/20 0.36
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
PRMT1 Q99873 1/20 0.35
PRMT8 Q9NR22 1/20 0.35
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
OPRL1 P41146 1/20 0.33
ALDH1A1 P00352 1/20 0.33
OPRK1 P41145 1/20 0.33
KCNA3 P22001 1/20 0.33

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
SCHEMBL25108944 0.88 SIGMAR1 (0.42) CHRM4SIGMAR1CARM1PRMT6PRMT1
SCHEMBL19681559 0.83 NCF1 (0.38) SIGMAR1CARM1PRMT6PRMT1PRMT8
SCHEMBL18389282 0.83 ARG1 (0.37) ARG1ARG2CHRM4SIGMAR1NOS3
SCHEMBL10092707 0.83 DRD2 (0.42)
SCHEMBL23105099 0.83 ARG1 (0.40) ARG1ARG2CHRM4CARM1PRMT6
SCHEMBL8085877 0.83 CARM1 (0.52) SIGMAR1CARM1PRMT6PRMT1PRMT8
SCHEMBL8252286 0.82 CYP1A2 (0.40) CARM1PRMT6PRMT1PRMT8ALDH1A1
SCHEMBL25075208 0.82 NCF1 (0.39) SIGMAR1CARM1PRMT6PRMT1PRMT8
SCHEMBL1381369 0.82 ARG1 (0.39) ARG1ARG2CHRM4SIGMAR1NOS3
SCHEMBL8245487 0.82 NCF1 (0.34) SIGMAR1CARM1PRMT6PRMT1PRMT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216513-A1 FATTY ACID-BIFUNCTIONAL DEGRADER CONJUGATES AND THEIR METHODS OF USE NOVARTIS AG (CH) 2024-07-04 US disclosed
US-20240025863-A1 SOS1 PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS BIOTHERYX, INC. 2024-01-25 US disclosed
US-20240025863-A1 SOS1 PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS BIOTHERYX, INC. 2024-01-25 US disclosed
WO-2022132603-A1 PDE4 DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2022-06-23 WO disclosed
WO-2022087335-A1 KRAS PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2022-04-28 WO disclosed
US-20210087213-A1 DIANILINOPYRIMIDINE COMPOUND FOR INHIBITING KINASE ACTIVITY SHENZHEN TARGETRX, INC. (CN) 2021-03-25 US disclosed
EP-3715343-A1 DIPHENYLAMINOPYRIMIDINE COMPOUND FOR INHIBITING KINASE ACTIVITY Shenzhen TargetRx, Inc. (CN) 2020-09-30 EP disclosed
US-8178531-B2 Antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2012-05-15 US disclosed
US-20110218175-A1 ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2011-09-08 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-20210087213-A1 DIANILINOPYRIMIDINE COMPOUND FOR INHIBITING KINASE ACTIVITY ALK, BRAF, MUSK ARG1 3960/4885ARG2 4594/4885CHRM4 4033/4885
US-20110218175-A1 ANTIVIRAL AGENTS EIF2AK2, HAVCR2, MAVS ARG1 295/4885ARG2 926/4885CHRM4 4803/4885
US-20240216513-A1 FATTY ACID-BIFUNCTIONAL DEGRADER CONJUGATES AND THEIR METHODS OF USE FASN, FABP1, SCD ARG1 2294/4885ARG2 1612/4885CHRM4 4838/4885
US-20240025863-A1 SOS1 PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS SOS1, SOS2, SOST ARG1 2924/4885ARG2 4655/4885CHRM4 4844/4885

“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.