SCHEMBL19105484

SCHEMBL19105484

CC(C)N1C[C@H](C)N[C@@H](C)C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
OPRD1 P41143 1/20 0.30

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
SCHEMBL681121 1.00 CYP2C9 (0.35) CYP2C9TSHRCYP2C19TDP1OPRD1
SCHEMBL2760276 1.00 CYP2C9 (0.35) CYP2C9TSHRCYP2C19TDP1OPRD1
SCHEMBL14085840 1.00 CYP2C9 (0.35) CYP2C9TSHRCYP2C19TDP1OPRD1
SCHEMBL21444359 1.00 CYP2C9 (0.35) CYP2C9TSHRCYP2C19TDP1OPRD1
SCHEMBL25105674 0.84
SCHEMBL21074961 0.84
SCHEMBL16491200 0.84
SCHEMBL25105676 0.84
SCHEMBL14085842 0.84 CYP2C9 (0.39) CYP2C9TSHRCYP2C19TDP1
SCHEMBL25097034 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827646-B2 Compounds for treating spinal muscular atrophy HOFFMANN-LA ROCHE INC. (US) 2023-11-28 US disclosed
US-11827646-B2 Compounds for treating spinal muscular atrophy HOFFMANN-LA ROCHE INC. (US) 2023-11-28 US disclosed
US-20230227470-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER VANDERBILT UNIVERSITY 2023-07-20 US disclosed
WO-2023099624-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-06-08 WO disclosed
WO-2022058745-A9 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AND THEIR USE IN THERAPY IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2022-05-27 WO disclosed
WO-2022058745-A2 NOVEL COMPOUNDS AND THEIR USE IN THERAPY IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2022-03-24 WO disclosed
US-20210147447-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. (US) 2021-05-20 US disclosed
WO-2020035031-A1 FUSED RING COMPOUNDS GENENTECH, INC. (US) 2020-02-20 WO disclosed
EP-3298017-B1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN LA ROCHE (CH) 2019-08-14 EP disclosed
EP-3160967-B1 N-(IMIDAZO[1,2-A]PYRAZIN-6-YL)-BENZAMIDE COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN LA ROCHE (CH) 2019-05-08 EP disclosed
US-10208067-B2 Compounds for treating spinal muscular atrophy HOFFMANN-LA ROCHE INC. (US) 2019-02-19 US disclosed
US-20180194781-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. (US) 2018-07-12 US disclosed
US-20180194781-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. (US) 2018-07-12 US disclosed
US-9975900-B2 Substituted imidazo[1,2-α]pyrazines for treating spinal muscular atrophy HOFFMANN-LA ROCHE INC. (US) 2018-05-22 US disclosed
US-9969754-B2 Compounds for treating spinal muscular atrophy HOFFMANN-LA ROCHE INC. (US) 2018-05-15 US disclosed
US-20170197990-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. (US) 2017-07-13 US disclosed
US-20170197969-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. (US) 2017-07-13 US disclosed
US-20170197969-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. (US) 2017-07-13 US disclosed
US-20170197990-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY HOFFMANN-LA ROCHE INC. (US) 2017-07-13 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 (7 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-20230227470-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER KRAS, NRAS, TP53 CYP2C9 1828/4885TSHR 1257/4885CYP2C19 1386/4885
US-20210147447-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, CPT1B, GYS1 CYP2C9 4505/4885TSHR 3021/4885CYP2C19 3934/4885
US-20170197990-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, CPT1B, GYS1 CYP2C9 4505/4885TSHR 3021/4885CYP2C19 3934/4885
US-20180194781-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, PYGM, CPT1B CYP2C9 4518/4885TSHR 3123/4885CYP2C19 4028/4885
US-11827646-B2 Compounds for treating spinal muscular atrophy SMN1; SMN2, CPT1B, GYS1 CYP2C9 4505/4885TSHR 3021/4885CYP2C19 3934/4885
US-20170197969-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, PYGM, GYS1 CYP2C9 3794/4885TSHR 2674/4885CYP2C19 3037/4885
US-10208067-B2 Compounds for treating spinal muscular atrophy SMN1; SMN2, PYGM, CPT1B CYP2C9 4518/4885TSHR 3123/4885CYP2C19 4028/4885

“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.