SCHEMBL6156729

SCHEMBL6156729

Cc1ccc(C2C=CNCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GID4 Q8IVV7 1/20 0.40
MAPT P10636 2/20 0.38
PRCP P42785 1/20 0.38
KDM1A O60341 1/20 0.35
MEN1 O00255 1/20 0.32
CYP2D6 P10635 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTR2C P28335 2/20 0.31
ACHE P22303 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2B P41595 1/20 0.31
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL8976942 0.81 PRCP (0.38) PRCPKDM1AATMHTR2CTDP1
SCHEMBL655217 0.81 HTR3A (0.43) PRCPKDM1A
SCHEMBL4169709 0.80 SLC18A3 (0.42) GID4PRCPKDM1AKMT2AHTR2A
Hydrochloric Acid SCHEMBL4470943 0.79 HTR3A (0.42) PRCPKDM1AHTR2CHTR2AHTR2B
SCHEMBL11540135 0.77 RECQL (0.38) MAPTNPSR1ALDH1A1
SCHEMBL5616363 0.77 HTR2C (0.50) MAPTKDM1AMEN1KMT2AHTR2C
SCHEMBL4840001 0.69 AHR (0.40) KDM1AMEN1KMT2AALDH1A1
SCHEMBL20561359 0.67 SMN1; SMN2 (0.37) GID4MAPTATMHTR2CACHE
SCHEMBL22416555 0.67 HTR2A (0.35) GID4MAPTPRCPKDM1AMEN1
SCHEMBL20561358 0.67 SMN1; SMN2 (0.37) GID4MAPTATMHTR2CACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937715-B1 TETRAHYDROBENZINDOLE COMPOUNDS MEIJI SEIKA KAISHA (JP) 2005-06-01 EP disclosed
US-6355642-B1 PSYCHOLOGICAL DISORDERS AND BRAIN DISORDERS MEIJI SEIKA KAISHA, LTD. (JP) 2002-03-12 US disclosed
EP-0937715-A1 TETRAHYDROBENZINDOLE COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 1999-08-25 EP disclosed