SCHEMBL21471472

SCHEMBL21471472

COC(=O)CCCCCCN(C)c1ccc(N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.43
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TSHR P16473 1/20 0.41
HPGD P15428 1/20 0.40
KDM5A P29375 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
PGR P06401 3/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38

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
SCHEMBL8993978 0.85 CYP1A2 (0.44) ALDH1A1KDM4EHSD17B10TSHRKMT2A
SCHEMBL1006764 0.84 LMNA (0.49) TSHRLMNAHDAC6
SCHEMBL8993953 0.84 CYP1A2 (0.45) ALDH1A1KDM4EHSD17B10TSHRLMNA
SCHEMBL31478350 0.83 LMNA (0.50) MLYCDALDH1A1KDM4EGAAMAPT
SCHEMBL31478356 0.83 LMNA (0.50) MLYCDALDH1A1KDM4EGAAMAPT
SCHEMBL31478349 0.83 LMNA (0.50) MLYCDALDH1A1KDM4EGAAMAPT
SCHEMBL22954599 0.81 MTNR1A (0.43) MLYCDALDH1A1KDM4EGAAMAPT
SCHEMBL8993946 0.79 CYP1A2 (0.46) ALDH1A1KDM4EGAATSHRLMNA
SCHEMBL20764316 0.78 ALDH1A1 (0.46) ALDH1A1GAAMAPTTSHRLMNA
SCHEMBL8993963 0.78 MMP14 (0.38) ALDH1A1GAAMAPTTSHRLMNA

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-20220002318-A1 HETEROCYCLIC COMPOUND AS SYK INHIBITOR AND/OR SYK-HDAC DUAL INHIBITOR HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2022-01-06 US disclosed
EP-3553065-A1 HETEROCYCLIC COMPOUND AS SYK INHIBITOR AND/OR SYK-HDAC DUAL INHIBITOR Hangzhou Innogate Pharma Co., Ltd. (CN) 2019-10-16 EP 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 (1 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-20220002318-A1 HETEROCYCLIC COMPOUND AS SYK INHIBITOR AND/OR SYK-HDAC DUAL INHIBITOR SYK, HDAC1, HDAC2 MLYCD 4105/4885ALDH1A1 2514/4885KDM4E 163/4885

“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.