SCHEMBL4322355

SCHEMBL4322355

Cc1ccc(F)cc1OCCOc1nccnc1N1CCNCC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.50
HTR6 P50406 2/20 0.41
SOS1 Q07889 1/20 0.38
REN P00797 4/20 0.37
HTR1A P08908 1/20 0.37
SLC6A2 P23975 1/20 0.37
CCNT1 O60563 1/20 0.37
CDK9 P50750 1/20 0.37

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
SCHEMBL4312678 0.88 HTR2C (0.41) HTR2CHTR6HTR1ASLC6A2
SCHEMBL4322400 0.88 TDP1 (0.43) HTR2CHTR1A
SCHEMBL6046287 0.88 CCNT1 (0.42) HTR2CHTR6CCNT1CDK9
SCHEMBL4314845 0.86 HTR2C (0.47) HTR2CHTR6HTR1ASLC6A2
SCHEMBL7469509 0.82 HTR2C (0.46) HTR2CHTR6HTR1ASLC6A2
SCHEMBL4319475 0.82 HTR2C (0.42) HTR2CHTR6SOS1HTR1ASLC6A2
SCHEMBL4313594 0.81 KCNH2 (0.35) HTR2CHTR6HTR1ASLC6A2
SCHEMBL4320202 0.81 HTR2C (0.50) HTR2CHTR6HTR1ASLC6A2
SCHEMBL2639856 0.80 HTR1A (0.46) HTR6HTR1ASLC6A2
SCHEMBL4313464 0.80 HTR1A (0.46) HTR2CHTR6HTR1ASLC6A2

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-7534794-B2 Certain arylaliphatic and heteroaryl-aliphatic piperazinyl pyrazines and their use in the treatment of serotonin-related diseases BIOVITRUM AB (SE) 2009-05-19 US disclosed
US-20030092694-A1 Certain arylaliphatic and heteroaryl-aliphatic piperazinyl pyrazines and their use in the treatment of serotonin-related diseases BIOVITRUM, AB, A STOCKHOLM, SWEDEN CORPORATION 2003-05-15 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-20030092694-A1 Certain arylaliphatic and heteroaryl-aliphatic piperazinyl pyrazines and their use in the treatment of serotonin-related diseases HTR2C, HTR3C, HTR2A HTR2C 1/4885HTR6 9/4885SOS1 2024/4885

“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.