SCHEMBL29601540

SCHEMBL29601540

O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1OC(n2cnc3c2ncn2ccnc32)[C@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 8/20 1.00
▸ P2RX2 Q9UBL9 6/20 1.00
▸ TAS1R3 Q7RTX0 1/20 0.84
▸ TAS1R1 Q7RTX1 1/20 0.84
▸ P2RY1 P47900 5/20 0.64
▸ P2RX1 P51575 3/20 0.64
▸ P2RX4 Q99571 3/20 0.64
▸ P2RY2 P41231 2/20 0.64
▸ SRC P12931 1/20 0.64
▸ ALDH1A1 P00352 1/20 0.64
▸ SMN1; SMN2 Q16637 1/20 0.64
▸ RNASEL Q05823 1/20 0.61
▸ ENPP1 P22413 1/20 0.60
▸ P2RY6 Q15077 1/20 0.60
▸ P2RY11 Q96G91 1/20 0.60
▸ GPR17 Q13304 1/20 0.60
▸ MACROD2 A1Z1Q3 1/20 0.60
▸ SIRT6 Q8N6T7 1/20 0.60
▸ MACROD1 Q9BQ69 1/20 0.60
▸ TRPM2 O94759 1/20 0.60

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
SCHEMBL10021603 1.00 P2RX3 (1.00) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL29395130 0.99 P2RX3 (0.98) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL840111 0.94 P2RX3 (0.88) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL20266301 0.91 TAS1R3 (1.00) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL20277494 0.91 TAS1R3 (1.00) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL20277542 0.91 TAS1R3 (1.00) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL20282630 0.91 TAS1R3 (1.00) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL30969959 0.91 TAS1R3 (0.98) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL29830053 0.89 P2RX3 (0.79) P2RX3P2RX2TAS1R3TAS1R1P2RY1
SCHEMBL4320468 0.87 P2RX3 (0.77) P2RX3P2RX2TAS1R3TAS1R1P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119232002-A Method and system for extracting key electromagnetic force harmonic waves of outer rotor permanent magnet synchronous motor 东南大学 2024-12-31 — — CN claimed
CN-112505665-B Space-time self-adaptive detection method and system suitable for partial uniform reverberation environment 中国科学院声学研究所 2023-06-23 — — CN claimed
CN-115876964-A Mobile monitoring and early warning method and system for city block climate environment and carbon emission 北方工业大学 2023-03-31 — — CN claimed
CN-114626505-A Mobile robot deep reinforcement learning control method 北京理工大学 2022-06-14 — — CN claimed
US-12516302-B2 DNA polymerase theta mutants, methods of producing these mutants, and their uses INSTITUT PASTEUR (FR) 2026-01-06 — — US disclosed
CN-119944642-A Power system fault prediction and self-healing control method and system 国网河北省电力有限公司邯郸市永年区供电分公司 2025-05-06 — — CN disclosed
CN-119380308-A Scene extraction generation and evaluation method for vehicle safety test 河南科技大学 2025-01-28 — — CN disclosed
CN-119232002-A Method and system for extracting key electromagnetic force harmonic waves of outer rotor permanent magnet synchronous motor 东南大学 2024-12-31 — — CN disclosed
CN-112505665-B Space-time self-adaptive detection method and system suitable for partial uniform reverberation environment 中国科学院声学研究所 2023-06-23 — — CN disclosed
CN-116189684-A User intention recognition method, system, computing device and storage medium 天津车之家软件有限公司 2023-05-30 — — CN disclosed
US-20230130605-A1 DNA POLYMERASE THETA MUTANTS, METHODS OF PRODUCING THESE MUTANTS, AND THEIR USES INSTITUT PASTEUR (FR) 2023-04-27 — — US disclosed
CN-115876964-A Mobile monitoring and early warning method and system for city block climate environment and carbon emission 北方工业大学 2023-03-31 — — CN disclosed
CN-115391718-A Radiation refrigerating capacity prediction method based on aerosol optical thickness correction 南京工业大学 2022-11-25 — — CN disclosed
US-11384345-B2 DNA polymerase theta mutants, methods of producing these mutants, and their uses INSTITUT PASTEUR (FR) 2022-07-12 — — US disclosed
CN-114155202-A Thyroid nodule ultrasonic image classification method based on feature fusion and transfer learning 南昌大学第一附属医院 2022-03-08 — — CN disclosed
Send feedback