SCHEMBL1898802

SCHEMBL1898802

O=C1c2c(Cl)cccc2C2CN(Cc3ccccc3)CC12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.49
DRD2 P14416 3/20 0.46
DRD3 P35462 3/20 0.46
S1PR5 Q9H228 2/20 0.43
S1PR1 P21453 1/20 0.43
FUCA1 P04066 2/20 0.42
TBXA2R P21731 1/20 0.41
SIGMAR1 Q99720 2/20 0.41
DRD4 P21917 1/20 0.40
RORC P51449 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL1894880 0.88 DPP4 (0.48) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL1893479 0.85 DPP4 (0.46) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL1895967 0.85 DPP4 (0.45) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL8489329 0.80 DRD2 (0.50) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL8500244 0.80 DRD2 (0.50) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL8497892 0.80 DRD2 (0.50) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL1891551 0.78 DPP4 (0.49) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL8318672 0.77 DPP4 (0.49) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL8318677 0.77 DPP4 (0.49) DPP4DRD2DRD3S1PR5S1PR1
SCHEMBL8318673 0.77 DPP4 (0.49) DPP4DRD2DRD3S1PR5S1PR1

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 11 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
EP-1841738-A2 TRICYCLIC INDENO-PYRROLE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS Athersys, Inc. (US) 2007-10-10 EP disclosed
WO-2007081299-A2 TRICYCLIC INDENO-PYRROLE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS ATHERSYS, INC. (US) 2007-07-19 WO 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 DPP4 843/4885DRD2 71/4885DRD3 146/4885
US-20110172283-A1 Tricyclic Indeno-Pyrrole Derivatives as Serotonin Receptor Modulators HTR5A, HTR3E, HTR1E DPP4 843/4885DRD2 71/4885DRD3 146/4885
US-20060025601-A1 Tricyclic indeno-pyrrole derivatives as serotonin receptor modulators HTR5A, HTR3E, HTR1E DPP4 843/4885DRD2 71/4885DRD3 146/4885
US-20090239925-A1 TRICYCLIC INDENO-PYRROLE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS HTR5A, HTR3E, HTR1E DPP4 843/4885DRD2 71/4885DRD3 146/4885
US-20140206739-A1 TRICYCLIC INDENO-PYRROLE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS HTR5A, HTR3E, HTR1E DPP4 843/4885DRD2 71/4885DRD3 146/4885

“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.