SCHEMBL31709109

SCHEMBL31709109

CCOc1cccc(F)c1CN1CCN(C(=O)[C@H](N)C2CCN(CCc3ccccc3Br)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 4/20 0.43
HTR2A P28223 1/20 0.40
POLB P06746 2/20 0.40
ALOX15 P16050 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CACNA1G O43497 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
OPRM1 P35372 1/20 0.36

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
SCHEMBL31708922 0.93 KDM4E (0.45) KDM4EALDH1A1HTR2APOLBALOX15
SCHEMBL31709169 0.91 SIGMAR1 (0.48) KDM4EALDH1A1POLBALOX15SMN1; SMN2
SCHEMBL31709274 0.91 KDM4E (0.43) KDM4EALDH1A1POLBALOX15TDP1
SCHEMBL31464103 0.90 ALDH1A1 (0.48) KDM4EALDH1A1HTR2APOLBALOX15
Hydrochloric Acid SCHEMBL27142912 0.90 ALDH1A1 (0.47) KDM4EALDH1A1HTR2APOLBALOX15
Hydrochloric Acid SCHEMBL27142909 0.90 ALDH1A1 (0.47) KDM4EALDH1A1HTR2APOLBALOX15
SCHEMBL31708691 0.89 ALDH1A1 (0.41) KDM4EALDH1A1POLBALOX15TDP1
SCHEMBL31709174 0.88 CHRM3 (0.46) KDM4EALDH1A1POLBALOX15TDP1
SCHEMBL31708717 0.88 KDM4E (0.41) KDM4EALDH1A1POLBALOX15TDP1
Hydrochloric Acid SCHEMBL31464144 0.88 ALDH1A1 (0.41) KDM4EALDH1A1POLBALOX15TDP1

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-20250326744-A1 PIPERAZINE DERIVATIVE OR SALT THEREOF, AND PHARMACEUTICAL COMPOSITION FUJIFILM CORPORATION (JP) 2025-10-23 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-20250326744-A1 PIPERAZINE DERIVATIVE OR SALT THEREOF, AND PHARMACEUTICAL COMPOSITION ABCB11, ABCC1, SLC11A2 KDM4E 2774/4885ALDH1A1 774/4885HTR2A 3355/4885

“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.