SCHEMBL2208629

SCHEMBL2208629

CC1(C)OC(=O)C(=CNc2ccc(OC(F)(F)F)cc2)C(=O)O1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 17/20 0.65
TSHR P16473 1/20 0.65
HSD17B10 Q99714 3/20 0.54
MAPK1 P28482 1/20 0.54
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
RAB9A P51151 2/20 0.47
GAA P10253 1/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.43
EPHX2 P34913 1/20 0.42

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
SCHEMBL3059418 0.82 ALDH1A1 (0.72) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL23456872 0.80 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL5739160 0.79 ALDH1A1 (1.00) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL15555582 0.77 ALDH1A1 (0.75) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL12786989 0.77 ALDH1A1 (0.75) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL3583405 0.77 ALDH1A1 (1.00) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL601203 0.76 ALDH1A1 (0.73) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL2175455 0.76 ALDH1A1 (0.63) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL14075911 0.75 ALDH1A1 (0.71) ALDH1A1TSHRHSD17B10MAPK1CYP1A2
SCHEMBL8114982 0.75 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10MAPK1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12486234-B2 PAPD5 inhibitors and methods of use thereof CHILDREN'S MEDICAL CENTER CORPORATION (US) 2025-12-02 US disclosed
CN-119798159-A PAPD5 inhibitors and methods of use thereof 儿童医学中心公司 2025-04-11 CN disclosed
US-20220274928-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION 2022-09-01 US disclosed
EP-3959197-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2022-03-02 EP disclosed
WO-2020219729-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2020-10-29 WO disclosed
WO-2020219729-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2020-10-29 WO disclosed
US-20140336182-A1 Aurora Kinase Modulators and Method of Use AMGEN INC (US) 2014-11-13 US disclosed
EP-2137177-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-05-07 EP disclosed
US-8557816-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2013-10-15 US disclosed
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2012-05-17 US disclosed
US-7981891-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2011-07-19 US disclosed
US-20100280008-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2010-11-04 US disclosed
US-7776857-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2010-08-17 US disclosed
EP-2137177-A2 AURORA KINASE MODULATORS AND METHOD OF USE Amgen, Inc (US) 2009-12-30 EP disclosed
US-20090069297-A1 Aurora kinase modulators and method of use AMGEN INC. (US) 2009-03-12 US disclosed
WO-2008124083-A2 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2008-10-16 WO 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 (6 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-20140336182-A1 Aurora Kinase Modulators and Method of Use AURKC, AURKA, CDK1 ALDH1A1 2075/4885TSHR 1239/4885HSD17B10 3362/4885
US-20220274928-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF POT1, PARP15, TERT ALDH1A1 2425/4885TSHR 3815/4885HSD17B10 1532/4885
US-20090069297-A1 Aurora kinase modulators and method of use AURKC, AURKA, CDK1 ALDH1A1 2075/4885TSHR 1239/4885HSD17B10 3362/4885
US-20100280008-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 ALDH1A1 2075/4885TSHR 1239/4885HSD17B10 3362/4885
US-12486234-B2 PAPD5 inhibitors and methods of use thereof POT1, PARP15, TERT ALDH1A1 2425/4885TSHR 3815/4885HSD17B10 1532/4885
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 ALDH1A1 2075/4885TSHR 1239/4885HSD17B10 3362/4885

“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.