SCHEMBL4882869

SCHEMBL4882869

CSC(=Nc1ccc(Cl)cc1)N1CCc2ccccc2CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
NOS1 P29475 3/20 0.44
NOS3 P29474 2/20 0.44
NOS2 P35228 2/20 0.44
ALDH1A1 P00352 3/20 0.42
CYP2D6 P10635 2/20 0.42
CYP1A2 P05177 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NOTUM Q6P988 1/20 0.42
AKR1C3 P42330 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
TMPRSS2 O15393 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
MAOA P21397 1/20 0.39
SLC6A2 P23975 1/20 0.39

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
SCHEMBL4882867 1.00 KMT2A (0.46) KMT2AMEN1GAANOS1NOS3
SCHEMBL8257533 1.00 KMT2A (0.46) KMT2AMEN1GAANOS1NOS3
SCHEMBL4884658 0.85 TAS1R3 (0.47) KMT2AMEN1GAANOS1NOS3
SCHEMBL4884664 0.85 TAS1R3 (0.47) KMT2AMEN1GAANOS1NOS3
SCHEMBL8259700 0.85 TAS1R3 (0.47) KMT2AMEN1GAANOS1NOS3
SCHEMBL4681025 0.81 HSD11B1 (0.50) ALDH1A1CYP2D6CYP1A2CYP2C9CYP2C19
SCHEMBL8259094 0.81 HSD11B1 (0.50) ALDH1A1CYP2D6CYP1A2CYP2C9CYP2C19
SCHEMBL4681026 0.81 HSD11B1 (0.50) ALDH1A1CYP2D6CYP1A2CYP2C9CYP2C19
SCHEMBL4885189 0.78 NOS3 (0.45) NOS1NOS3NOS2ALDH1A1CYP2D6
SCHEMBL14066257 0.78 NOS3 (0.45) NOS1NOS3NOS2ALDH1A1CYP2D6

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-20080234252-A1 Compounds Useful in Therapy PFIZER INC 2008-09-25 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-20080234252-A1 Compounds Useful in Therapy AVPR1A, AVPR1B, AVPR2 KMT2A 2146/4885MEN1 1843/4885GAA 4597/4885

“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.