SCHEMBL22018659

SCHEMBL22018659

BC(=O)CCCCC(=O)NC(C)C(=O)NC(C)C(=O)P

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.33
SLC6A5 Q9Y345 1/20 0.33
CASP1 P29466 1/20 0.32
DNM1 Q05193 1/20 0.32
THRB P10828 1/20 0.31
PLA2G10 O15496 2/20 0.31
ASAH2 Q9NR71 1/20 0.30

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
SCHEMBL22047456 1.00 FAAH (0.39) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL22018660 0.85 FAAH (0.56) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL22019559 0.83 TSHR (0.42) FAAHMEN1MAPK1KMT2A
SCHEMBL22019557 0.83 TSHR (0.42) FAAHMEN1MAPK1KMT2A
SCHEMBL22018460 0.83 PSMB5 (0.43) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL25052997 0.71 FAAH (0.54) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL26231705 0.71 FAAH (0.42) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL26231684 0.71 FAAH (0.42) FAAHMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL20436320 0.71 AKT1 (0.36) FAAHSMN1; SMN2
SCHEMBL20436175 0.71 AKT1 (0.36) FAAHSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210230114-A1 METHODS OF PREPARING CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2021-07-29 US disclosed
US-10913713-B2 Methods of preparing cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2021-02-09 US disclosed
US-20200172481-A1 METHODS OF PREPARING CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2020-06-04 US disclosed
WO-2020102053-A1 METHODS OF PREPARING CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2020-05-22 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-20210230114-A1 METHODS OF PREPARING CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA3, GABRA5, GABRA6 FAAH 2024/4885MEN1 2163/4885MAPK1 3961/4885
US-10913713-B2 Methods of preparing cytotoxic benzodiazepine derivatives GABRA3, GABRA5, GABRA6 FAAH 2024/4885MEN1 2163/4885MAPK1 3961/4885
US-20200172481-A1 METHODS OF PREPARING CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA3, GABRA5, GABRA6 FAAH 2024/4885MEN1 2163/4885MAPK1 3961/4885

“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.