SCHEMBL20059528

SCHEMBL20059528

CCNC[C@@H]1Cc2ccccc2N1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.48
BRD4 O60885 2/20 0.41
CREBBP Q92793 2/20 0.41
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
MTNR1B P49286 1/20 0.38
DRD3 P35462 1/20 0.35
AR P10275 1/20 0.35
PNMT P11086 1/20 0.34
HTR2A P28223 1/20 0.34
HRH1 P35367 1/20 0.34

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
SCHEMBL31599421 0.83 HTR2A (0.47) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL20169747 0.83 HTR2A (0.47) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL14471642 0.83 HTR2A (0.47) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL22955423 0.80 CREBBP (0.59) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL549073 0.80 CREBBP (0.59) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL11491245 0.80 MTNR1A (0.37) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL11391465 0.79 MTNR1A (0.54) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL14454193 0.79 GAA (0.42) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL550098 0.77 CREBBP (0.44) MTNR1ABRD4CREBBPGAAMAPT
SCHEMBL20330128 0.77 MTNR1A (0.56) MTNR1ABRD4CREBBPGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3313884-B9 ANTI-CD123 ANTIBODIES AND CONJUGATES AND DERIVATIVES THEREOF IMMUNOGEN INC (US) 2021-05-19 EP disclosed
EP-3769787-A1 CONJUGATES OF CYSTEINE ENGINEERED ANTIBODIES ImmunoGen, Inc. (US) 2021-01-27 EP disclosed
EP-3313884-B1 ANTI-CD123 ANTIBODIES AND CONJUGATES AND DERIVATIVES THEREOF IMMUNOGEN INC (US) 2020-11-18 EP disclosed
EP-3189056-B1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2020-06-10 EP disclosed
EP-3100745-B1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2018-04-18 EP disclosed