SCHEMBL21135638

SCHEMBL21135638

CC1CN(C(=O)OC(C)(C)C)CC=C1O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.41
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GPR119 Q8TDV5 5/20 0.39
ESR2 Q92731 1/20 0.39
PDK4 Q16654 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
PTPN2 P17706 1/20 0.38
PTPN1 P18031 1/20 0.38
PTPN6 P29350 1/20 0.38
MAPK1 P28482 1/20 0.38
NAMPT P43490 1/20 0.38
GRM5 P41594 1/20 0.38

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
SCHEMBL19759343 0.84 NR1H2 (0.41) NR1H2USP2SMN1; SMN2GPR119PDK4
SCHEMBL16052667 0.83 USP30 (0.40) NR1H2USP2SMN1; SMN2GPR119PDK4
SCHEMBL16052666 0.83 USP30 (0.40) NR1H2USP2SMN1; SMN2GPR119PDK4
SCHEMBL25047623 0.81 PDK4 (0.39) NR1H2USP2SMN1; SMN2GPR119PDK4
SCHEMBL26136585 0.81 NR1H2 (0.44) NR1H2USP2SMN1; SMN2GPR119PDK4
SCHEMBL30848770 0.79 USP2 (0.44) NR1H2USP2SMN1; SMN2GPR119PDK4
SCHEMBL15785128 0.77 GPR119 (0.39) NR1H2GPR119PDK4NAMPT
SCHEMBL4934988 0.77 USP30 (0.46) GPR119PDK4KDM4ENAMPTGRM5
SCHEMBL28036127 0.77 USP2 (0.40) NR1H2USP2SMN1; SMN2GPR119PDK4
SCHEMBL29178745 0.76 STS (0.40) NR1H2GPR119PDK4KDM4ENAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10385036-B2 Sulfonamide-substituted indole modulators of RORC2 and methods of use thereof PFIZER INC. (US) 2019-08-20 US disclosed
US-10336748-B2 Methyoxy-substituted pyrrolopyridine modulators of RORC2 and methods of use thereof PFIZER INC. (US) 2019-07-02 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 (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-10336748-B2 Methyoxy-substituted pyrrolopyridine modulators of RORC2 and methods of use thereof RORC, RORB, RORA NR1H2 13/4885USP2 3144/4885SMN1; SMN2 3331/4885
US-10385036-B2 Sulfonamide-substituted indole modulators of RORC2 and methods of use thereof RORC, RORB, RORA NR1H2 21/4885USP2 2329/4885SMN1; SMN2 3701/4885

“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.