SCHEMBL3373528

SCHEMBL3373528

CCCCN(Cc1ccccc1)C1CC1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.70
MEN1 O00255 3/20 0.57
RAB9A P51151 1/20 0.57
SLC6A2 P23975 4/20 0.51
SLC6A4 P31645 4/20 0.51
SLC6A3 Q01959 1/20 0.51
DRD2 P14416 2/20 0.48
DRD3 P35462 1/20 0.48
GRIN2B Q13224 2/20 0.47
ACKR3 P25106 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ATM Q13315 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
YTHDC1 Q96MU7 1/20 0.44
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL3373703 0.93 KMT2A (0.67) KMT2AMEN1RAB9ASLC6A2SLC6A4
SCHEMBL3373916 0.89 KMT2A (0.60) KMT2AMEN1RAB9ASLC6A2SLC6A4
SCHEMBL11794019 0.87 KMT2A (0.56) KMT2AMEN1RAB9ASLC6A2SLC6A4
SCHEMBL4489240 0.84 SLC6A2 (0.73) KMT2AMEN1RAB9ASLC6A2SLC6A4
SCHEMBL31687534 0.83 KMT2A (0.51) KMT2AMEN1RAB9ASLC6A2SLC6A4
SCHEMBL17984967 0.83 KMT2A (0.51) KMT2AMEN1RAB9ASLC6A2SLC6A4
SCHEMBL3376642 0.83 KMT2A (0.57) KMT2AMEN1RAB9ASLC6A2SLC6A4
SCHEMBL3371525 0.82 GRIN2B (0.63) KMT2AMEN1RAB9ASLC6A2SLC6A4
Hydrochloric Acid SCHEMBL31687542 0.81 KMT2A (0.50) KMT2AMEN1RAB9ASLC6A2SLC6A4
SCHEMBL3376962 0.81 YTHDC1 (0.58) KMT2AMEN1RAB9ASLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100324091-A1 Pyrazolone Derivative KOWA COMPANY, LTD. (JP) 2010-12-23 US disclosed
EP-2172458-A1 PYRAZOLONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-04-07 EP 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-20100324091-A1 Pyrazolone Derivative SERPINE1, SERPINC1, TFPI KMT2A 4670/4885MEN1 2985/4885RAB9A 3319/4885

“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.