SCHEMBL19616629

SCHEMBL19616629

COC(=O)CCC(C)(C)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 3/20 0.41
CA12 O43570 2/20 0.41
CA14 Q9ULX7 2/20 0.41
KDM4E B2RXH2 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 2/20 0.40
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
TET2 Q6N021 1/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
SLC1A1 P43005 1/20 0.33

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
Ammonia Solution, Strong SCHEMBL28127724 0.98 TSHR (0.55) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL12926133 0.84 TSHR (0.58) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL19299334 0.82 TSHR (0.56) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL27994582 0.82 TSHR (0.60) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL889856 0.82 TSHR (0.60) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL28695618 0.82 TSHR (0.60) TSHRALDH1A1KMT2AMEN1LMNA
Dimethyl Succinate SCHEMBL28327672 0.80 TSHR (0.65) TSHRALDH1A1KMT2AMEN1LMNA
Ammonia Solution, Strong SCHEMBL3920826 0.80 TSHR (0.57) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL25021755 0.78 TSHR (0.55) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL6762562 0.78 TSHR (0.55) TSHRALDH1A1KMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250186543-A1 CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL, INC. 2025-06-12 US disclosed
CN-118324867-A Novel cyclosporin derivatives and uses thereof 美国科技环球有限公司 2024-07-12 CN disclosed
CN-109476705-B Novel cyclosporin derivatives and uses thereof 美国科技环球有限公司 2024-02-27 CN disclosed
US-11827586-B2 Method for producing amino acid aminoalkyl ester or inorganic acid salt thereof ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-11-28 US disclosed
US-20220331397-A1 CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. 2022-10-20 US disclosed
CN-114891070-A Anthelmintic depsipeptide compounds 勃林格殷格翰动物保健美国公司 2022-08-12 CN disclosed
CN-107835818-B Anthelmintic depsipeptide compounds 勃林格殷格翰动物保健美国公司 2022-04-29 CN disclosed
EP-3831841-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T Global Inc. (US) 2021-06-09 EP disclosed
US-20190151403-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. 2019-05-23 US disclosed
EP-3458470-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T Global Inc. (US) 2019-03-27 EP disclosed
CN-109476705-A novel cyclosporin derivatives and use thereof 美国科技环球有限公司 2019-03-15 CN disclosed
WO-2017200984-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. (US) 2017-11-23 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-20250186543-A1 CYCLOSPORIN DERIVATIVES AND USES THEREOF MALT1, MTPN, MYLK2 TSHR 3832/4885ALDH1A1 1876/4885KMT2A 4548/4885
US-20220331397-A1 CYCLOSPORIN DERIVATIVES AND USES THEREOF MALT1, MTPN, MYLK2 TSHR 3832/4885ALDH1A1 1876/4885KMT2A 4548/4885
US-20190151403-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF MALT1, MYLK2, FKBP1B TSHR 4178/4885ALDH1A1 2805/4885KMT2A 4599/4885
US-11827586-B2 Method for producing amino acid aminoalkyl ester or inorganic acid salt thereof SLC6A15, SLC6A19, ALAD TSHR 3390/4885ALDH1A1 1123/4885KMT2A 3098/4885

“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.