SCHEMBL22313664

SCHEMBL22313664

CN(C)c1ccc(-c2cnc(/C=C(\C#N)C(=O)NCCOCCOCCCCCCCl)s2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.39
KMT2A Q03164 6/20 0.39
LMNA P02545 6/20 0.39
MEN1 O00255 5/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MAPK1 P28482 3/20 0.39
MITF O75030 2/20 0.39
HPGD P15428 2/20 0.39
MDM2 Q00987 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
USP2 O75604 1/20 0.39
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ESRRA P11474 1/20 0.38
PSMD14 O00487 1/20 0.38
KDM4E B2RXH2 4/20 0.38
MAPT P10636 3/20 0.38
POLB P06746 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PKM P14618 1/20 0.36

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
SCHEMBL22313661 0.87 ALDH1A1 (0.38) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22313635 0.87 MAPT (0.42) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22295765 0.85 ALDH1A1 (0.53) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22313662 0.81 APP (0.50) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22313622 0.78 ALDH1A1 (0.38) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22314182 0.77 ALDH1A1 (0.39) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22295757 0.76 ALDH1A1 (0.40) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22295768 0.76 ALDH1A1 (0.47) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22313630 0.75 ALDH1A1 (0.39) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL22314048 0.74 ALDH1A1 (0.39) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200248069-A1 FLUORESCENT PROBE, PREPARATION METHOD THEREFOR AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2020-08-06 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 (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-20200248069-A1 FLUORESCENT PROBE, PREPARATION METHOD THEREFOR AND USE THEREOF WASF2, FAM162A, HASPIN ALDH1A1 3475/4885KMT2A 4790/4885LMNA 1071/4885

“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.