SCHEMBL2968205

SCHEMBL2968205

Nc1cn(Cc2ccccc2F)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
KDM5B Q9UGL1 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MAPT P10636 2/20 0.50
KDM4A O75164 1/20 0.50
KDM5A P29375 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
PKM P14618 1/20 0.50
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
POLB P06746 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.40
CYP2A13 Q16696 1/20 0.39
PIM1 P11309 1/20 0.39
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38

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
SCHEMBL24845157 0.83 KDM5B (0.52) ALDH1A1MEN1KMT2AKDM5BL3MBTL1
SCHEMBL31478624 0.81 KDM5B (0.46) ALDH1A1KDM5BKDM4AKDM5AKDM4C
SCHEMBL26276579 0.80 KDM5B (0.50) ALDH1A1MEN1KMT2AKDM5BL3MBTL1
SCHEMBL22718313 0.80 KDM5B (0.50) ALDH1A1MEN1KMT2AKDM5BL3MBTL1
SCHEMBL24845233 0.80 KDM5B (0.50) ALDH1A1MEN1KMT2AKDM5BL3MBTL1
SCHEMBL31331998 0.80 KDM5B (0.50) ALDH1A1MEN1KMT2AKDM5BL3MBTL1
SCHEMBL22747288 0.78 KDM5B (0.48) ALDH1A1MEN1KMT2AKDM5BL3MBTL1
SCHEMBL9714348 0.77 KDM5B (0.54) ALDH1A1MEN1KMT2AKDM5BL3MBTL1
SCHEMBL22747342 0.76 KDM5B (0.47) ALDH1A1MEN1KMT2AKDM5BL3MBTL1
SCHEMBL2972635 0.75 HPGDS (0.51) KDM5BMAPTKDM5AKDM4CNPC1

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
US-7781435-B2 Imidazole compounds for the treatment of neurological disorders PFIZER INC (US) 2010-08-24 US claimed
US-20070066613-A1 Imidazole compounds for the treatment of neurological disorders PFIZER INC 2007-03-22 US claimed
US-7781435-B2 Imidazole compounds for the treatment of neurological disorders PFIZER INC (US) 2010-08-24 US disclosed
US-20100184737-A1 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PFIZER INC (US) 2010-07-22 US disclosed
US-20070066613-A1 Imidazole compounds for the treatment of neurological disorders PFIZER INC 2007-03-22 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 (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-20070066613-A1 Imidazole compounds for the treatment of neurological disorders APP, PSEN1, BACE1 ALDH1A1 807/4885MEN1 485/4885KMT2A 2322/4885
US-20100184737-A1 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS APP, PSEN1, BACE1 ALDH1A1 807/4885MEN1 485/4885KMT2A 2322/4885

“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.