SCHEMBL30345614

SCHEMBL30345614

OC1(c2ccccc2)c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ P2RX1 P51575 1/20 0.48
▸ P2RX3 P56373 1/20 0.48
▸ P2RX4 Q99571 1/20 0.48
▸ P2RX7 Q99572 1/20 0.48
▸ PDK2 Q15119 3/20 0.48
▸ CFTR P13569 1/20 0.42
▸ GOPC Q9HD26 1/20 0.42
▸ APEX1 P27695 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ HSP90AB1 P08238 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40

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
SCHEMBL813078 1.00 THRB (0.52) THRBTDP1P2RX1P2RX3P2RX4
SCHEMBL17816933 0.98 THRB (0.50) THRBTDP1P2RX1P2RX3P2RX4
SCHEMBL30281291 0.92 PDK2 (0.50) THRBTDP1P2RX1P2RX3P2RX4
SCHEMBL19039047 0.92 PDK2 (0.50) THRBTDP1P2RX1P2RX3P2RX4
SCHEMBL18386005 0.91 THRB (0.45) THRBTDP1P2RX1P2RX3P2RX4
SCHEMBL13387439 0.91 P2RX1 (0.46) THRBTDP1P2RX1P2RX3P2RX4
Pyridine SCHEMBL27936442 0.88 RXFP1 (0.45) THRBTDP1P2RX1P2RX3P2RX4
SCHEMBL1758787 0.87 P2RX1 (0.53) THRBTDP1P2RX1P2RX3P2RX4
SCHEMBL11490930 0.87 CFTR (0.46) THRBTDP1P2RX1P2RX3P2RX4
SCHEMBL22876054 0.87 PDK2 (0.50) THRBTDP1P2RX1P2RX3P2RX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023233371-A1 A CONTINUOUS FLOW PROCESS FOR SYNTHESIS OF ORGANIC AZIDES Indian Institute of Science Education and Research, Pune (IISER Pune) (IN) 2023-12-07 — — WO disclosed
CN-113582823-B Preparation method of 2-amino-9,9-diphenylfluorene 河北凡克新材料有限公司 2023-04-07 — — CN disclosed
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