SCHEMBL22332274

SCHEMBL22332274

CC(C)CCNC(=O)C1CCN(C(=O)CSC(C)(C)C)CC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.61
▸ EPHX2 P34913 1/20 0.45
▸ MAPT P10636 3/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TP53 P04637 3/20 0.40
▸ PTPN1 P18031 1/20 0.39
▸ CYP3A4 P08684 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ ITGB3 P05106 1/20 0.37
▸ ITGA2B P08514 1/20 0.37
▸ F2R P25116 1/20 0.37

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
SCHEMBL16591602 0.85 HSD17B10 (0.41) HSD17B10LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL20939157 0.84 PTGES (0.41) HSD17B10SMN1; SMN2TSHRALDH1A1ITGB3
SCHEMBL25959561 0.82 HSD17B10 (0.40) HSD17B10LMNASMN1; SMN2CYP3A4TSHR
SCHEMBL25959855 0.82 HSD17B10 (0.40) HSD17B10LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL27105971 0.81 HSD17B10 (0.62) HSD17B10EPHX2MAPTLMNAHTT
SCHEMBL20381521 0.81 HSD17B10 (0.62) HSD17B10EPHX2MAPTLMNAHTT
SCHEMBL20939096 0.80 HSD17B10 (0.61) HSD17B10EPHX2MAPTLMNAHTT
SCHEMBL20381638 0.77 HSD17B10 (0.64) HSD17B10EPHX2MAPTLMNAHTT
SCHEMBL12197917 0.75 HSD17B10 (0.68) HSD17B10EPHX2MAPTLMNAHTT
SCHEMBL7750667 0.74 HSD17B10 (0.66) HSD17B10EPHX2MAPTLMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11718630-B2 Compositions and methods for treating cancer THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-08-08 — — US disclosed
US-20230135350-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-05-04 — — US disclosed
US-20210230183-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-07-29 — — US disclosed
US-11008334-B2 Compositions and methods for treating cancer THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-05-18 — — US disclosed
US-20200255446-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-08-13 — — 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 (5 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-20230135350-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER KRAS, HRAS, NRAS HSD17B10 3787/4885EPHX2 2775/4885MAPT 3731/4885
US-11718630-B2 Compositions and methods for treating cancer KRAS, HRAS, NRAS HSD17B10 3787/4885EPHX2 2775/4885MAPT 3731/4885
US-20210230183-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER KRAS, HRAS, NRAS HSD17B10 3787/4885EPHX2 2775/4885MAPT 3731/4885
US-20200255446-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER KRAS, HRAS, NRAS HSD17B10 3787/4885EPHX2 2775/4885MAPT 3731/4885
US-11008334-B2 Compositions and methods for treating cancer KRAS, HRAS, NRAS HSD17B10 3787/4885EPHX2 2775/4885MAPT 3731/4885

“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.

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