SCHEMBL4074066

SCHEMBL4074066

Fc1cccc(C2[CH]C2)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
TAAR1 Q96RJ0 1/20 0.43
KDM1A O60341 3/20 0.42
RCOR1 Q9UKL0 1/20 0.42
ACHE P22303 1/20 0.39
CYP19A1 P11511 1/20 0.39
NOS3 P29474 1/20 0.39
RIPK1 Q13546 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
GFER P55789 1/20 0.38
NFE2L2 Q16236 1/20 0.38
P2RX7 Q99572 2/20 0.38

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
SCHEMBL28247572 0.83 HTR2A (0.43) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL28064118 0.77 HTR2A (0.39) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL777518 0.77 HTR2A (0.39) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL16877131 0.77 HTR2A (0.39) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL29447418 0.76 HTR2A (0.44) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL24950120 0.75 TAAR1 (0.48) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL29878889 0.74 HTR2C (0.47) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL1515236 0.74 HTR2C (0.47) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL4071919 0.74 TAAR1 (0.39) HTR2AHTR2CHTR2BTAAR1KDM1A
SCHEMBL16879137 0.74 SLC6A2 (0.38) HTR2AHTR2CHTR2BTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101626686-A 3-substituent-1, 2, 3-benzotriazinone compounds for improving glutaminic synaptic responses CORTEX PHARMA INC 2010-01-13 CN claimed
CN-109589325-B A kind of pharmaceutical composition and preparation method thereof for treating enteritis 牡丹江医学院 2019-11-26 CN disclosed
CN-109589325-A A kind of pharmaceutical composition and preparation method thereof for treating enteritis 牡丹江医学院 2019-04-09 CN disclosed
CN-101626686-A 3-substituent-1, 2, 3-benzotriazinone compounds for improving glutaminic synaptic responses CORTEX PHARMA INC 2010-01-13 CN disclosed
EP-1415986-B1 SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS BANYU PHARMA CO LTD (JP) 2009-04-08 EP disclosed
US-7205417-B2 Spiro compounds BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-04-17 US disclosed
CN-1538956-A Spiro compounds ������ҩ��ʽ���� 2004-10-20 CN disclosed
US-5714503-A Compounds and methods for inhibition of HIV and related viruses MEDIVIR AB (SE) 1998-02-03 US disclosed