SCHEMBL8128635

SCHEMBL8128635

COc1cc2ccn(CCCN(C)C)c2cc1OC

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 3/20 0.56
▸ HTR2C P28335 3/20 0.56
▸ HDAC3 O15379 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ NCOR2 Q9Y618 1/20 0.45
▸ SMPD1 P17405 1/20 0.44
▸ HTR1D P28221 4/20 0.44
▸ BPTF Q12830 4/20 0.43
▸ NOS3 P29474 3/20 0.43
▸ NOS1 P29475 3/20 0.43
▸ NOS2 P35228 1/20 0.42
▸ EGFR P00533 1/20 0.42
▸ ABCB1 P08183 1/20 0.42

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
SCHEMBL23956097 0.91 HTR2C (0.67) HTR2AHTR2CHDAC3HDAC1HDAC2
SCHEMBL8127772 0.82 HTR2C (0.68) HTR2AHTR2CHDAC3HDAC1HDAC2
SCHEMBL6870435 0.78 HDAC3 (0.48) HTR2AHTR2CHDAC3HDAC1HDAC2
SCHEMBL6928247 0.75 PRKCI (0.51) HTR2AHTR2CHTR1DBPTFNOS3
SCHEMBL7253554 0.75 HTR2A (0.54) HTR2AHTR2CHTR1DBPTFNOS3
SCHEMBL8113042 0.75 HDAC3 (0.41) HTR2AHTR2CHDAC3HDAC1HDAC2
SCHEMBL16741930 0.75 EGFR (0.53) HTR2AHTR2CBPTFNOS3NOS1
SCHEMBL23956099 0.74 HTR2C (0.61) HTR2AHTR2CHTR1DNOS3NOS1
SCHEMBL23927851 0.73 HTR2C (0.47) HTR2AHTR2C
SCHEMBL24110335 0.73 HTR2C (0.40) HTR2AHTR2CHDAC3HDAC1HDAC2

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-0642513-B1 INDOLOCARBAZOLE IMIDES AND THEIR USE KTB TUMORFORSCHUNGSGESELLSCHAF (DE) 2000-08-09 — — EP disclosed
US-5945440-A Indolocarbazole imides and the use thereof GOEDECKE AKTIENGESELLSCHAFT (DE) 1999-08-31 — — US disclosed
US-5883114-A TREATING CANCEROUS TUMORS, INFLAMMATORY DISEASES, AND ALLERGIES GOEDECKE AKTIENGESELLSCHAFT (DE) 1999-03-16 — — US disclosed
EP-0642513-A1 INDOLOCARBAZOLE IMIDES AND THEIR USE GÖDECKE AKTIENGESELLSCHAFT (DE) 1995-03-15 — — EP disclosed
WO-1993024491-A1 INDOLOCARBAZOLE IMIDES AND THEIR USE Gödecke Aktiengesellschaft (DE) 1993-12-09 — — WO disclosed
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