SCHEMBL6528941

SCHEMBL6528941

CN1CC[C@H](c2c[nH]c3ccccc23)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 1.00
ATM Q13315 1/20 1.00
CYP2D6 P10635 1/20 0.64
BRD4 O60885 1/20 0.60
ALDH1A1 P00352 1/20 0.60
POLB P06746 1/20 0.60
CREBBP Q92793 1/20 0.60
ADRA1D P25100 4/20 0.58
ADRB2 P07550 1/20 0.56
HTR2C P28335 1/20 0.56

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
SCHEMBL6529902 1.00 KDM4E (1.00) KDM4EATMCYP2D6BRD4ALDH1A1
SCHEMBL5253835 1.00 KDM4E (1.00) KDM4EATMCYP2D6BRD4ALDH1A1
SCHEMBL10212688 0.91 KDM4E (0.84) KDM4EATMCYP2D6BRD4ALDH1A1
SCHEMBL30415306 0.91 KDM4E (0.83) KDM4EATMCYP2D6BRD4ALDH1A1
SCHEMBL3256692 0.91 KDM4E (0.83) KDM4EATMCYP2D6BRD4ALDH1A1
Hydrochloric Acid SCHEMBL27732898 0.89 KDM4E (0.81) KDM4EATMCYP2D6BRD4ALDH1A1
SCHEMBL24736335 0.87 KDM4E (0.77) KDM4EATMCYP2D6BRD4ALDH1A1
SCHEMBL1720727 0.82 KDM4E (0.70) KDM4EATMCYP2D6BRD4ALDH1A1
SCHEMBL19210848 0.82 KDM4E (0.70) KDM4EATMCYP2D6BRD4ALDH1A1
SCHEMBL8508491 0.81 KDM4E (0.68) KDM4EATMCYP2D6

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
WO-2005066157-A1 3-(PYROLIDIN-3-L) INDOLES AS 5-HT6 RECEPTOR MODULATORS SUVEN LIFE SCIENCES (IN) 2005-07-21 WO disclosed
EP-0666858-B1 5-ARYLINDOLE DERIVATIVES AND THEIR USE AS SEROTONIN (5-HT 1) AGONISTS PFIZER (US) 2001-06-13 EP disclosed
EP-1094064-A1 5-arylindolederivatives and their use as serotonin(5-ht1)agonists PFIZER INC. (US) 2001-04-25 EP disclosed
EP-0619805-B1 5-(HETERO- OR CARBOCYCLYLAMINO)-INDOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS 5-HT1 AGONISTS PFIZER (US) 2000-03-15 EP disclosed
US-5886008-A 5-arylindole derivatives PFIZER INC. (US) 1999-03-23 US disclosed
US-5639752-A SEROTONIN AGONIST PFIZER INC (US) 1997-06-17 US disclosed
EP-0666858-A1 5-ARYLINDOLE DERIVATIVES AND THEIR USE AS SEROTONIN (5-HT 1?) AGONISTS PFIZER INC. (US) 1995-08-16 EP disclosed
EP-0619805-A1 INDOLE DERIVATIVES PFIZER HOSPITAL PRODUCTS, INC. (US) 1994-10-19 EP disclosed
WO-1994010171-A1 5-ARYLINDOLE DERIVATIVES AND THEIR USE AS SEROTONIN (5-HT1) AGONISTS PFIZER INC. (US) 1994-05-11 WO disclosed
WO-1993011106-A1 INDOLE DERIVATIVES PFIZER, INC. (US) 1993-06-10 WO disclosed