SCHEMBL7872035

SCHEMBL7872035

c1cc2c3c(ccc2[nH]1)NCC3

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.44
GRIA1 P42261 1/20 0.40
GRIA2 P42262 1/20 0.40
GRIA3 P42263 1/20 0.40
GRIA4 P48058 1/20 0.40
HTR1D P28221 10/20 0.40
HTR1B P28222 7/20 0.40
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
PARP10 Q53GL7 1/20 0.35
PARP11 Q9NR21 1/20 0.35
AHR P35869 1/20 0.34
ADRB1 P08588 1/20 0.34
HTR6 P50406 1/20 0.34
PARP1 P09874 1/20 0.33

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
SCHEMBL5655667 0.77 NOTUM (0.41) NOTUMGRIA1GRIA2GRIA3GRIA4
SCHEMBL28381050 0.73 HTR1D (0.37) HTR1DHTR1BCYP1A2AHRPARP1
SCHEMBL3495344 0.69 HTR1D (0.40) HTR1DHTR1BAHRADRB1HTR6
SCHEMBL13497870 0.69 ALDH1A1 (0.48) NOTUMGRIA1GRIA2GRIA3GRIA4
SCHEMBL5365445 0.69 DRD2 (0.37) NOTUMPARP1
SCHEMBL2398840 0.68 AHR (0.52) HTR1DHTR1BAHRADRB1HTR6
SCHEMBL4382926 0.68 NOTUM (0.42) NOTUMGRIA1GRIA2GRIA3GRIA4
SCHEMBL7617146 0.67 PNMT (0.49) HTR1DHTR1B
SCHEMBL582334 0.67 NOTUM (0.46) NOTUMKDM4EMEN1CYP1A2HPGD
SCHEMBL31727562 0.67 HTR1D (0.53) HTR1DHTR1BPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-54130597-A None JP disclosed
JP-54130598-A None JP disclosed
EP-4598586-A1 DRUG LINKERS AND ANTIBODY CONJUGATES THEREOF Ambrx, Inc. (US) 2025-08-13 EP disclosed
WO-2024077277-A1 DRUG LINKERS AND ANTIBODY CONJUGATES THEREOF AMBRX, INC. (US) 2024-04-11 WO disclosed
CN-116348614-A Switching oligonucleotides 牛津大学创新有限公司 2023-06-27 CN disclosed
CN-103764843-B For the method and composition for the risk for determining heart failure or heart failure 罗塞塔金诺米克斯有限公司 2017-09-08 CN disclosed
US-6312925-B1 EFFICIENT TARGETING AND MODIFICATION OF SEQUENCES IN DUPLEX DNA BY USING OLIGONUCLEOTIDE HAVING FIRST DOMAIN WHICH LOCALIZES TO VICINITY OF TARGET AND SECOND DOMAIN HAVING ATTACHED AGENT CAPABLE OF MODIFYING THE TARGET EPOCH PHARMACEUTICALS, INC. 2001-11-06 US disclosed
JP-S54130598-A PREPARATION OF 1,2-DIHYDRO-3H-PYRROLO3,2-EINDOLE DERIVATIVE MITSUI TOATSU CHEM INC 1979-10-09 JP disclosed
JP-S54130597-A PREPARATION OF 1,2-DIHYDRO-3H-PYRROLO3,2-EINDOLE DERIVATIVE MITSUI TOATSU CHEM INC 1979-10-09 JP disclosed