SCHEMBL6220656

SCHEMBL6220656

Fc1cccc(F)c1-c1ccc2c(c1)[C@@H]1CNCC[C@@H]1N2

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.43
HTR2A P28223 5/20 0.38
KCNH2 Q12809 3/20 0.38
HTR2B P41595 3/20 0.36
PIM1 P11309 2/20 0.35
PIM3 Q86V86 2/20 0.35
PIM2 Q9P1W9 2/20 0.35
CHRM1 P11229 1/20 0.33
HTR6 P50406 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 1/20 0.33
TYK2 P29597 1/20 0.32

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
SCHEMBL6249002 1.00 HTR2C (0.43) HTR2CHTR2AKCNH2HTR2BPIM1
SCHEMBL6217278 0.93 HTR2C (0.43) HTR2CHTR2AKCNH2HTR2BCHRM1
Hydrochloric Acid SCHEMBL6786724 0.90 PIM1 (0.37) HTR2CHTR2BPIM1PIM3PIM2
SCHEMBL6219238 0.87 HTR2C (0.37) HTR2CHTR2AKCNH2HTR2B
SCHEMBL6216357 0.82 KDM4E (0.41) HTR2CHTR2AKCNH2HTR2B
SCHEMBL7141991 0.80 HTR2A (0.44) HTR2CHTR2AKCNH2HTR2BHTR6
SCHEMBL7141988 0.80 HTR2A (0.44) HTR2CHTR2AKCNH2HTR2BHTR6
SCHEMBL10154877 0.79 PGR (0.42) HTR2CHTR2AKCNH2
SCHEMBL6216581 0.77 GRIA1 (0.40) HTR2C
SCHEMBL6215612 0.77 MEN1 (0.39) HTR2CHTR2AKCNH2HTR2BHTR6

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
EP-1414819-B1 THERAPEUTIC 1H-PYRIDO[4,3-b]INDOLES PHARMACIA & UPJOHN CO LLC (US) 2005-10-12 EP claimed
US-20030060464-A1 Therapeutic 1H-pyrido [ 4, 3-b ] indoles PHARMACIA & UPJOHN COMPANY 2003-03-27 US claimed
EP-1414819-B1 THERAPEUTIC 1H-PYRIDO[4,3-b]INDOLES PHARMACIA & UPJOHN CO LLC (US) 2005-10-12 EP disclosed
US-6849640-B2 Therapeutic 1H-pyrido [4,3-b] indoles PHARMACIA & UPJOHN COMPANY (US) 2005-02-01 US disclosed
US-20030060464-A1 Therapeutic 1H-pyrido [ 4, 3-b ] indoles PHARMACIA & UPJOHN COMPANY 2003-03-27 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-20030060464-A1 Therapeutic 1H-pyrido [ 4, 3-b ] indoles HTR3B, HTR4, HTR3C HTR2C 12/4885HTR2A 18/4885KCNH2 2178/4885

“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.