SCHEMBL15540893

SCHEMBL15540893

NC(=O)C(=C(c1ccccc1)N1CCOCC1)N1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 1/20 0.49
HPGD P15428 2/20 0.48
TSHR P16473 2/20 0.48
PHGDH O43175 1/20 0.48
GAA P10253 1/20 0.46
AKR1C3 P42330 1/20 0.45
KMT2A Q03164 4/20 0.44
ALDH1A1 P00352 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
USP2 O75604 1/20 0.43
MEN1 O00255 1/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
PLA2G7 Q13093 1/20 0.42
FAAH O00519 1/20 0.42
MGLL Q99685 1/20 0.42
NCOA3 Q9Y6Q9 1/20 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
SCHEMBL15540890 1.00 SMN1; SMN2 (0.49) SMN1; SMN2LMNAHTTHPGDTSHR
SCHEMBL15540895 0.79 SMN1; SMN2 (0.50) SMN1; SMN2LMNAHTTHPGDTSHR
SCHEMBL8727982 0.77 MGLL (0.59) SMN1; SMN2LMNAHTTHPGDTSHR
SCHEMBL16781072 0.72 SMN1; SMN2 (0.49) SMN1; SMN2LMNAHTTHPGDTSHR
SCHEMBL16781071 0.72 SMN1; SMN2 (0.49) SMN1; SMN2LMNAHTTHPGDTSHR
SCHEMBL16781273 0.70 SMN1; SMN2 (0.47) SMN1; SMN2LMNAHTTHPGDTSHR
SCHEMBL16781272 0.70 SMN1; SMN2 (0.47) SMN1; SMN2LMNAHTTHPGDTSHR
SCHEMBL946143 0.70 HPGD (0.86) SMN1; SMN2LMNAHPGDTSHRPHGDH
SCHEMBL30449295 0.69 HPGD (0.83) SMN1; SMN2LMNAHPGDTSHRPHGDH
Ammonia Solution, Strong SCHEMBL6028542 0.69 HPGD (0.83) SMN1; SMN2LMNAHPGDTSHRPHGDH

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-20230140433-A1 INHIBITORS OF BTK AND MUTANTS THEREOF NEWAVE PHARMACEUTICAL INC. 2023-05-04 US disclosed
US-20200377478-A1 INHIBITORS OF BTK AND MUTANTS THEREOF NEWAVE PHARMACEUTICAL INC. 2020-12-03 US disclosed
EP-2844642-A1 COMPOUNDS FOR INHIBITING CELL PROLIFERATION IN EGFR-DRIVEN CANCERS ARIAD PHARMACEUTICALS, INC. (US) 2015-03-11 EP disclosed
WO-2013169401-A1 COMPOUNDS FOR INHIBITING CELL PROLIFERATION IN EGFR-DRIVEN CANCERS ARIAD PHARMACEUTICALS, INC. (US) 2013-11-14 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 (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-20230140433-A1 INHIBITORS OF BTK AND MUTANTS THEREOF BTK, SYK, LYN SMN1; SMN2 3898/4885LMNA 3480/4885HTT 4040/4885
US-20200377478-A1 INHIBITORS OF BTK AND MUTANTS THEREOF BTK, SYK, LYN SMN1; SMN2 3913/4885LMNA 3695/4885HTT 4018/4885

“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.