SCHEMBL23680948

SCHEMBL23680948

C[C@@H]1CCCN1C(=O)CC1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ GAA P10253 2/20 0.45
▸ KMT2A Q03164 2/20 0.43
▸ MAPK1 P28482 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ CHRM2 P08172 1/20 0.39
▸ CHRM4 P08173 1/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ CHRM3 P20309 1/20 0.39
▸ NAMPT P43490 1/20 0.39
▸ DPP4 P27487 4/20 0.39
▸ FAP Q12884 4/20 0.39
▸ DPP7 Q9UHL4 4/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL19143407 1.00 HPGD (0.47) HPGDSMN1; SMN2GAAKMT2AMAPK1
SCHEMBL26786294 0.93 HPGD (0.45) HPGDSMN1; SMN2GAAKMT2AMAPK1
SCHEMBL18731290 0.85 CNR1 (0.43) HPGDSMN1; SMN2GAAKMT2AMAPK1
SCHEMBL16254979 0.83 CNR1 (0.47) HPGDSMN1; SMN2GAAKMT2AMAPK1
SCHEMBL24067460 0.79 ALDH1A1 (0.48) HPGDKMT2AALDH1A1MEN1RAB9A
SCHEMBL20038765 0.79 EPHX1 (0.38) HPGDKMT2AALDH1A1DPP4FAP
SCHEMBL7542036 0.77 POLB (0.59) HPGDKMT2AALDH1A1MEN1CHRM2
SCHEMBL7542043 0.77 POLB (0.59) HPGDKMT2AALDH1A1MEN1CHRM2
SCHEMBL14218669 0.77 HPGD (0.47) HPGDSMN1; SMN2GAAKMT2AMAPK1
SCHEMBL13674784 0.77 HPGD (0.47) HPGDSMN1; SMN2GAAKMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230218669-A1 AUGMENTING ANTIGEN-NEGATIVE CELL DEATH IN ANTIGEN-TARGETED IMMUNOTHERAPIES FRED HUTCHINSON CANCER CENTER (US) 2023-07-13 — — US disclosed
US-11358950-B2 SMAC mimetics used as IAP inhibitors and use thereof CHIA TAI TIANGQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-06-14 — — US disclosed
US-20210371400-A1 SMAC MIMETICS USED AS IAP INHIBITORS AND USE THEREOF CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-12-02 — — US disclosed
WO-2021148396-A1 EPIDERMAL GROWTH FACTOR RECEPTOR TYROSINE KINASE INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2021-07-29 — — 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 (3 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-20210371400-A1 SMAC MIMETICS USED AS IAP INHIBITORS AND USE THEREOF BIRC7, BIRC5, BIRC2 HPGD 3229/4885SMN1; SMN2 419/4885GAA 1183/4885
US-20230218669-A1 AUGMENTING ANTIGEN-NEGATIVE CELL DEATH IN ANTIGEN-TARGETED IMMUNOTHERAPIES CD47, BAD, CD74 HPGD 3254/4885SMN1; SMN2 602/4885GAA 511/4885
US-11358950-B2 SMAC mimetics used as IAP inhibitors and use thereof BIRC7, BIRC5, BIRC2 HPGD 3229/4885SMN1; SMN2 419/4885GAA 1183/4885

“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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