SCHEMBL14726472

SCHEMBL14726472

Cc1cc(C(F)(F)F)nn1C1CCCCO1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
GAA P10253 2/20 0.42
ATR Q13535 3/20 0.38
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
RET P07949 4/20 0.34
NR3C2 P08235 1/20 0.34
CYP2C19 P33261 1/20 0.33
TLR8 Q9NR97 1/20 0.32

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
SCHEMBL18758369 0.83 CYP4F2 (0.37) CYP4F2CYP4A11GAAATRLMNA
SCHEMBL8932232 0.83 CYP4F2 (0.44) CYP4F2CYP4A11GAAATRLMNA
SCHEMBL22604901 0.83 GAA (0.42) CYP4F2CYP4A11GAAATRLMNA
SCHEMBL22824028 0.82 MEN1 (0.37) CYP4F2CYP4A11GAAATRLMNA
SCHEMBL14726450 0.80 GAA (0.47) CYP4F2CYP4A11GAAATRLMNA
SCHEMBL3039870 0.80 CYP4F2 (0.37) CYP4F2CYP4A11GAAATRLMNA
SCHEMBL3631508 0.79 CYP4F2 (0.34) CYP4F2CYP4A11GAAATRLMNA
SCHEMBL21024096 0.79 GAA (0.44) GAALMNAALDH1A1NR3C2TLR8
SCHEMBL30705522 0.78 NR3C2 (0.36) CYP4F2CYP4A11GAAATRRXRA
SCHEMBL22449667 0.78 CYP4F2 (0.44) CYP4F2CYP4A11GAAATRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230271940-A1 HETEROARYL SUBSTITUTED 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2023-08-31 US disclosed
US-11524963-B2 Substituted pyrazolo[3,4-d]pyrimidines as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2022-12-13 US disclosed
WO-2019143991-A1 SUBSTITUTED PYRAZOLO[3,4-d]PYRIMIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2019-07-25 WO disclosed
US-9947482-B2 Photoelectric conversion element, dye-sensitized solar cell, and metal complex dye used in same FUJIFILM CORPORATION (JP) 2018-04-17 US disclosed
US-20160042875-A1 PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, AND METAL COMPLEX DYE USED IN SAME FUJIFILM CORPORATION (JP) 2016-02-11 US disclosed
US-20130053382-A1 Inhibitors of Phosphoinositide Dependent Kinase 1 (PDK1) PALIWAL SUNIL (US) 2013-02-28 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-20130053382-A1 Inhibitors of Phosphoinositide Dependent Kinase 1 (PDK1) PDK1, PDPK1, PDK3 CYP4F2 4667/4885CYP4A11 4197/4885GAA 1210/4885
US-11524963-B2 Substituted pyrazolo[3,4-d]pyrimidines as RET kinase inhibitors RET, ROR1, BRAF CYP4F2 1933/4885CYP4A11 2395/4885GAA 3222/4885
US-20230271940-A1 HETEROARYL SUBSTITUTED 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES AND USES THEREOF XDH, SLCO1B3, ROR1 CYP4F2 259/4885CYP4A11 238/4885GAA 1150/4885
US-20160042875-A1 PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, AND METAL COMPLEX DYE USED IN SAME CRY1, L1CAM, DLK1 CYP4F2 3241/4885CYP4A11 2690/4885GAA 1768/4885

“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.