SCHEMBL19954875

SCHEMBL19954875

CC(C)c1cccc(CC(C)c2cccc(CC(C)c3cccnc3)n2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
CLK1 P49759 1/20 0.37
DYRK1A Q13627 1/20 0.37
NAMPT P43490 1/20 0.37
CYP3A4 P08684 4/20 0.35
CYP2D6 P10635 4/20 0.35
KCNH2 Q12809 4/20 0.35
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 3/20 0.35
SLC6A3 Q01959 3/20 0.35
RORC P51449 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
GRM2 Q14416 3/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
LMNA P02545 1/20 0.33
ACHE P22303 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
SCHEMBL20968027 0.87 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1HTTCLK1DYRK1A
SCHEMBL19646227 0.85 SMN1; SMN2 (0.38) SMN1; SMN2CYP3A4CYP2D6KCNH2SLC6A2
SCHEMBL18427396 0.85 SMN1; SMN2 (0.38) SMN1; SMN2CYP3A4CYP2D6KCNH2SLC6A2
SCHEMBL26399905 0.84 KCNH2 (0.31) SMN1; SMN2CYP3A4CYP2D6KCNH2SLC6A2
SCHEMBL22374288 0.83 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1HTTCLK1DYRK1A
SCHEMBL21653566 0.81 SMN1; SMN2 (0.33) SMN1; SMN2CYP3A4CYP2D6KCNH2SLC6A2
SCHEMBL21451766 0.79 BACE1 (0.35) SMN1; SMN2CYP3A4CYP2D6KCNH2SLC6A2
SCHEMBL22166482 0.79 RXRA (0.34) SMN1; SMN2ALDH1A1HTTCYP3A4CYP2D6
SCHEMBL29296781 0.78 LMNA (0.33) SMN1; SMN2KCNH2L3MBTL1LMNAKDM4E
SCHEMBL24397435 0.77 NAMPT (0.38) SMN1; SMN2NAMPTL3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230000843-A1 MEDICINAL COGNITIVE TREATMENTS Actinogen Medical Limited (AU) 2023-01-05 US disclosed
US-11241450-B2 Uridine diphosphate derivatives, prodrugs, compositions and uses thereof TUFTS UNIVERSITY (US) 2022-02-08 US disclosed
US-11124536-B2 Uridine nucleoside derivatives, compositions and methods of use TUFTS UNIVERSITY (US) 2021-09-21 US disclosed
US-20210221803-A1 ATF6 INHIBITORS AND USES THEREOF ALTOS LABS, INC. 2021-07-22 US disclosed
US-20210069226-A1 URIDINE DIPHOSPHATE DERIVATIVES, PRODRUGS, COMPOSITIONS AND USES THEREOF TUFTS UNIVERSITY (US) 2021-03-11 US disclosed
US-20200399302-A1 URIDINE NUCLEOSIDE DERIVATIVES, COMPOSITIONS AND METHODS OF USE TUFTS UNIVERSITY 2020-12-24 US disclosed
US-10829485-B2 ATF6 inhibitors and uses thereof BLACK BELT TX LTD (GB) 2020-11-10 US disclosed
US-10632138-B2 Uridine diphosphate derivatives, prodrugs, compositions and uses thereof TUFTS UNIVERSITY (US) 2020-04-28 US disclosed
US-20180085386-A1 URIDINE MONOPHOSPHATE AND TRIPHOSPHATE DERIVATIVES, COMPOSITIONS AND METHODS OF USE TUFTS UNIVERSITY 2018-03-29 US disclosed
US-9913855-B2 Uridine diphosphate derivatives, prodrugs, compositions and uses thereof TUFTS UNIVERSITY (US) 2018-03-13 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 (9 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-11124536-B2 Uridine nucleoside derivatives, compositions and methods of use P2RY6, UPP1, UMPS SMN1; SMN2 278/4885ALDH1A1 2982/4885HTT 818/4885
US-20200399302-A1 URIDINE NUCLEOSIDE DERIVATIVES, COMPOSITIONS AND METHODS OF USE P2RY6, UPP1, UMPS SMN1; SMN2 278/4885ALDH1A1 2982/4885HTT 818/4885
US-20180085386-A1 URIDINE MONOPHOSPHATE AND TRIPHOSPHATE DERIVATIVES, COMPOSITIONS AND METHODS OF USE P2RY6, UPP1, UMPS SMN1; SMN2 410/4885ALDH1A1 3211/4885HTT 872/4885
US-20230000843-A1 MEDICINAL COGNITIVE TREATMENTS PYGB, CHAT, COMT SMN1; SMN2 270/4885ALDH1A1 1344/4885HTT 311/4885
US-10829485-B2 ATF6 inhibitors and uses thereof ATF4, XBP1, ATF1 SMN1; SMN2 1522/4885ALDH1A1 4447/4885HTT 713/4885
US-20210221803-A1 ATF6 INHIBITORS AND USES THEREOF ATF4, XBP1, ATF1 SMN1; SMN2 1522/4885ALDH1A1 4447/4885HTT 713/4885
US-20210069226-A1 URIDINE DIPHOSPHATE DERIVATIVES, PRODRUGS, COMPOSITIONS AND USES THEREOF UMPS, UPP1, UGDH SMN1; SMN2 789/4885ALDH1A1 1514/4885HTT 701/4885
US-11241450-B2 Uridine diphosphate derivatives, prodrugs, compositions and uses thereof UMPS, UPP1, UGDH SMN1; SMN2 789/4885ALDH1A1 1514/4885HTT 701/4885
US-10632138-B2 Uridine diphosphate derivatives, prodrugs, compositions and uses thereof UMPS, UPP1, UGDH SMN1; SMN2 789/4885ALDH1A1 1514/4885HTT 701/4885

“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.