SCHEMBL1893897

SCHEMBL1893897

O=C(O)C1CN(Cc2ccccc2)CC1F

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 6/20 0.56
S1PR1 P21453 2/20 0.56
FUCA1 P04066 2/20 0.51
RORC P51449 1/20 0.48
ALDH1A1 P00352 1/20 0.47
GRIN2B Q13224 1/20 0.46
BCHE P06276 1/20 0.45
GBA1 P04062 1/20 0.44
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL1188233 0.88 S1PR5 (0.65) S1PR5S1PR1FUCA1RORCALDH1A1
SCHEMBL6231237 0.88 S1PR5 (0.65) S1PR5S1PR1FUCA1RORCALDH1A1
SCHEMBL1188230 0.88 S1PR5 (0.65) S1PR5S1PR1FUCA1RORCALDH1A1
SCHEMBL6231248 0.88 S1PR5 (0.65) S1PR5S1PR1FUCA1RORCALDH1A1
SCHEMBL18929830 0.84 KDM4E (0.54) ALDH1A1
SCHEMBL29644792 0.82 FUCA1 (0.60) S1PR5S1PR1FUCA1ALDH1A1GBA1
SCHEMBL1836650 0.82 FUCA1 (0.60) S1PR5S1PR1FUCA1ALDH1A1GBA1
SCHEMBL1891761 0.82 S1PR5 (0.58) S1PR5S1PR1FUCA1RORCALDH1A1
SCHEMBL4522412 0.82 FUCA1 (0.67) S1PR5S1PR1FUCA1RORCALDH1A1
SCHEMBL1891026 0.82 USP30 (0.54) S1PR5S1PR1ALDH1A1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096520-B2 Tricyclic ideno-pyrrole derivatives as serotonin receptor modulators ABT HOLDING COMPANY (US) 2015-08-04 US disclosed
US-20140206739-A1 TRICYCLIC INDENO-PYRROLE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS ABT HOLDING COMPANY (US) 2014-07-24 US disclosed
US-8716324-B2 Tricyclic indeno-pyrrole derivatives as serotonin receptor modulators ATHERSYS, INC. (US) 2014-05-06 US disclosed
US-20120252859-A1 Tricyclic Indeno-Pyrrole Derivatives as Serotonin Receptor Modulators ATHERSYS, INC. (US) 2012-10-04 US disclosed
US-8232311-B2 Tricyclic indeno-pyrrole derivatives as serotonin receptor modulators ATHERSYS, INC. (US) 2012-07-31 US disclosed
US-20110172283-A1 Tricyclic Indeno-Pyrrole Derivatives as Serotonin Receptor Modulators BENNANI YOUSSEF L 2011-07-14 US disclosed
US-7935830-B2 Tricyclic indeno-pyrrole derivatives as serotonin receptor modulators ATHERSYS, INC. (US) 2011-05-03 US disclosed
US-20090239925-A1 TRICYCLIC INDENO-PYRROLE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS ATHERSYS, INC. 2009-09-24 US disclosed
CN-101516372-A Tricyclic indeno-pyrrole derivatives as serotonin receptor modulators ATHERSYS INC (US) 2009-08-26 CN disclosed
US-20060025601-A1 Tricyclic indeno-pyrrole derivatives as serotonin receptor modulators ATHERSYS, INC. 2006-02-02 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 (5 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-20120252859-A1 Tricyclic Indeno-Pyrrole Derivatives as Serotonin Receptor Modulators HTR5A, HTR3E, HTR1E S1PR5 455/4885S1PR1 997/4885FUCA1 4794/4885
US-20110172283-A1 Tricyclic Indeno-Pyrrole Derivatives as Serotonin Receptor Modulators HTR5A, HTR3E, HTR1E S1PR5 455/4885S1PR1 997/4885FUCA1 4794/4885
US-20060025601-A1 Tricyclic indeno-pyrrole derivatives as serotonin receptor modulators HTR5A, HTR3E, HTR1E S1PR5 455/4885S1PR1 997/4885FUCA1 4794/4885
US-20090239925-A1 TRICYCLIC INDENO-PYRROLE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS HTR5A, HTR3E, HTR1E S1PR5 455/4885S1PR1 997/4885FUCA1 4794/4885
US-20140206739-A1 TRICYCLIC INDENO-PYRROLE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS HTR5A, HTR3E, HTR1E S1PR5 455/4885S1PR1 997/4885FUCA1 4794/4885

“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.