SCHEMBL15935199

SCHEMBL15935199

CC(C)(C)c1scc2ccncc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.38
KIF11 P52732 1/20 0.34
MAOA P21397 2/20 0.34
CYP2A6 P11509 1/20 0.33
LATS1 O95835 7/20 0.33
LATS2 Q9NRM7 6/20 0.33
KDM4E B2RXH2 2/20 0.33
HTT P42858 2/20 0.33
TNF P01375 1/20 0.33
POLB P06746 1/20 0.33
RAD52 P43351 1/20 0.33
ROCK2 O75116 2/20 0.32
PRKCH P24723 2/20 0.32
PRKCQ Q04759 2/20 0.32
ROCK1 Q13464 2/20 0.32
PKN1 Q16512 2/20 0.32
PKN2 Q16513 2/20 0.32
PRKCB P05771 1/20 0.32
PRKCA P17252 1/20 0.32
PRKCE Q02156 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
SCHEMBL16891599 0.75 MAOA (0.37) MAOACYP2A6KDM4EHTTTNF
SCHEMBL11654778 0.73 CYP2A6 (0.35) MAOACYP2A6KDM4EHTTTNF
SCHEMBL11916071 0.72 CCR4 (0.39) CCR4CYP2A6KDM4ESMN1; SMN2ALDH1A1
SCHEMBL19957790 0.71 CYP2A6 (0.36) MAOACYP2A6KDM4EHTTTNF
SCHEMBL19633536 0.70 KDM4E (0.36) MAOACYP2A6LATS1LATS2KDM4E
SCHEMBL16417587 0.70 MAOA (0.38) MAOACYP2A6LATS1LATS2KDM4E
SCHEMBL15935287 0.67
SCHEMBL15935237 0.67 XPO1 (0.31) KIF11LATS1LATS2
SCHEMBL10253539 0.67 CYP2A6 (0.47) CCR4KIF11CYP2A6LATS1LATS2
SCHEMBL15935213 0.67 CD38 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190083482-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2019-03-21 US disclosed
US-20180162847-A1 PRMT5 INHIBITORS CONTAINING A DIHYDRO- OR TETRAHYDROISOQUINOLINE AND USES THEREOF Epizyme, Inc. (US) 2018-06-14 US disclosed
US-9765068-B2 PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2017-09-19 US disclosed
US-9745291-B2 PRMT5 inhibitors containing a dihydro- or tetrahydroisoquinoline and uses thereof Epizyme, Inc. (US) 2017-08-29 US disclosed
US-20170210751-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-07-27 US disclosed
US-9604930-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2017-03-28 US disclosed
US-9604930-B2 Tetrahydro- and dihydro-isoquinoline PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2017-03-28 US disclosed
US-20160368907-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-12-22 US disclosed
US-20150361042-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-12-17 US disclosed
US-20150344434-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-12-03 US disclosed
US-20150344433-A1 PRMT5 INHIBITORS CONTAINING A DIHYDRO- OR TETRAHYDROISOQUINOLINE AND USES THEREOF Epizyme, Inc. (US) 2015-12-03 US disclosed
US-20150191432-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-07-09 US disclosed
US-8940726-B2 PRMT5 inhibitors and uses thereof Epizyme, Inc. (US) 2015-01-27 US disclosed
US-20140221345-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-08-07 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-20150191432-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 CCR4 4520/4885KIF11 3513/4885MAOA 3906/4885
US-20140221345-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 CCR4 4520/4885KIF11 3513/4885MAOA 3906/4885
US-20150344433-A1 PRMT5 INHIBITORS CONTAINING A DIHYDRO- OR TETRAHYDROISOQUINOLINE AND USES THEREOF PRMT5, PRMT1, PRMT3 CCR4 4351/4885KIF11 3580/4885MAOA 3714/4885
US-20190083482-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 CCR4 4520/4885KIF11 3513/4885MAOA 3906/4885
US-20160368907-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 CCR4 4520/4885KIF11 3513/4885MAOA 3906/4885
US-20150361042-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 CCR4 4509/4885KIF11 3501/4885MAOA 3412/4885
US-20170210751-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 CCR4 3995/4885KIF11 4004/4885MAOA 3093/4885
US-20180162847-A1 PRMT5 INHIBITORS CONTAINING A DIHYDRO- OR TETRAHYDROISOQUINOLINE AND USES THEREOF PRMT5, PRMT1, PRMT3 CCR4 4351/4885KIF11 3580/4885MAOA 3714/4885
US-20150344434-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT3 CCR4 4369/4885KIF11 3520/4885MAOA 3968/4885

“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.