SCHEMBL23384529

SCHEMBL23384529

CC(=O)c1ccc(C(=O)N2CCC(N)(CO)CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ GABRD O14764 1/20 0.43
▸ GABRA1 P14867 1/20 0.43
▸ GABRB1 P18505 1/20 0.43
▸ GABRA5 P31644 1/20 0.43
▸ GABRA3 P34903 1/20 0.43
▸ GABRA2 P47869 1/20 0.43
▸ GABRB2 P47870 1/20 0.43
▸ GABRA4 P48169 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ HPGD P15428 1/20 0.43
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ ITGB3 P05106 2/20 0.42
▸ ITGA2B P08514 2/20 0.42

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
SCHEMBL20739480 0.91 S1PR1 (0.44) HSD11B1POLBGABRDGABRA1GABRB1
SCHEMBL23384398 0.88 ITGB3 (0.46) POLBGABRDGABRA1GABRB1GABRA5
SCHEMBL20739605 0.86 S1PR1 (0.46) POLBGABRDGABRA1GABRB1GABRA5
SCHEMBL23384545 0.80 S1PR1 (0.42) POLBGABRDGABRA1GABRB1GABRA5
SCHEMBL20739693 0.78 HPGD (0.41) HSD11B1ALDH1A1HPGDMEN1KMT2A
SCHEMBL20722196 0.77 ALDH1A1 (0.62) ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL20722178 0.77 HPGD (0.51) POLBHPGDCA12CA1CA2
SCHEMBL20739606 0.77 HPGD (0.51) POLBHPGDCA12CA1CA2
SCHEMBL23384541 0.75 S1PR1 (0.41) GABRDGABRA1GABRB1GABRA5GABRA3
SCHEMBL11376680 0.75 HPGD (0.76) HSD11B1ALDH1A1HPGDCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11059784-B2 Oxime ether compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2021-07-13 — — US disclosed
US-20210147361-A1 OXIME ETHER COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-05-20 — — 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 (2 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-20210147361-A1 OXIME ETHER COMPOUNDS S1PR1, S1PR3, S1PR2 HSD11B1 859/4885POLB 2678/4885GABRD 3028/4885
US-11059784-B2 Oxime ether compounds S1PR1, S1PR3, S1PR2 HSD11B1 868/4885POLB 2719/4885GABRD 2910/4885

“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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