SCHEMBL17858846

SCHEMBL17858846

CCOC(=O)C1CCC(O[Si](C)(C)C(C)(C)C)C1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPM1D O15297 1/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TSHR P16473 1/20 0.36
PPM1B O75688 1/20 0.36
PTPN1 P18031 1/20 0.36
PPP1CC P36873 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
SCHEMBL15541522 0.93 PPM1D (0.41) PPM1DMAPTALDH1A1MEN1KMT2A
SCHEMBL5009369 0.91 MAPT (0.43) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL516752 0.91 MAPT (0.43) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL12549970 0.91 MAPT (0.43) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL22283634 0.91 MEN1 (0.38) PPM1DMAPTALDH1A1MEN1KMT2A
SCHEMBL20502795 0.91 MEN1 (0.38) PPM1DMAPTALDH1A1MEN1KMT2A
SCHEMBL22357286 0.84 SMN1; SMN2 (0.36) PPM1DALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL19148890 0.84 SMN1; SMN2 (0.36) PPM1DALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL16167661 0.84 SMN1; SMN2 (0.36) PPM1DALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL16690752 0.82 MAPT (0.34) PPM1DMAPTALDH1A1MEN1KMT2A

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-10617692-B2 Pyrrolopyrimidine comprising cyclopentyl substituent CENTAURUS BIOPHARMA CO. (CN) 2020-04-14 US disclosed
US-10617692-B2 Pyrrolopyrimidine comprising cyclopentyl substituent CENTAURUS BIOPHARMA CO. (CN) 2020-04-14 US disclosed
US-10561657-B2 Pyrrolopyrimidine compound Centaurus Biophrama Co., Ltd. (CN) 2020-02-18 US disclosed
US-20190201403-A1 PYRROLOPYRIMIDINE COMPOUND LIANYUNGANG RUNZHONG PHARMACEUTICAL CO., LTD. (CN) 2019-07-04 US disclosed
US-20190183899-A1 PYRROLOPYRIMIDINE COMPRISING CYCLOPENTYL SUBSTITUENT CENTAURUS BIOPHARMA CO., LTD. (CN) 2019-06-20 US disclosed
US-20190183899-A1 PYRROLOPYRIMIDINE COMPRISING CYCLOPENTYL SUBSTITUENT CENTAURUS BIOPHARMA CO., LTD. (CN) 2019-06-20 US disclosed
EP-3235819-A1 PYRROLOPYRIMIDINE COMPOUND Centaurus BioPharma Co., Ltd. (CN) 2017-10-25 EP disclosed
WO-2016095805-A1 PYRROLOPYRIMIDINE COMPOUND 北京赛林泰医药技术有限公司 2016-06-23 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 (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-10561657-B2 Pyrrolopyrimidine compound JAK2, JAK1, JAK3 PPM1D 75/4885MAPT 3008/4885ALDH1A1 1027/4885
US-20190201403-A1 PYRROLOPYRIMIDINE COMPOUND JAK2, JAK1, JAK3 PPM1D 75/4885MAPT 3008/4885ALDH1A1 1027/4885
US-10617692-B2 Pyrrolopyrimidine comprising cyclopentyl substituent JAK1, JAK2, JAK3 PPM1D 120/4885MAPT 2480/4885ALDH1A1 814/4885
US-20190183899-A1 PYRROLOPYRIMIDINE COMPRISING CYCLOPENTYL SUBSTITUENT JAK1, JAK2, JAK3 PPM1D 120/4885MAPT 2480/4885ALDH1A1 814/4885

“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.