SCHEMBL5176602

SCHEMBL5176602

CCCCCCCCCCCCCCCCCC(N)(N)N

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.50
FDPS P14324 2/20 0.50
TSHR P16473 2/20 0.50
THRB P10828 1/20 0.50
DNM1 Q05193 8/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.45
EPHX1 P07099 1/20 0.45
GGPS1 O95749 1/20 0.42

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
SCHEMBL25278181 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL1837471 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL1835454 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL25271033 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL25221553 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL25272640 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL25275199 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL25272240 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL22400688 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL118383 1.00 SMPD1 (0.50) SMPD1FDPSTSHRTHRBDNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12209184-B2 Asphalt additives ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) 2025-01-28 US disclosed
EP-4446310-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND Asahi Kasei Kabushiki Kaisha (JP) 2024-10-16 EP disclosed
CN-118382612-A Method for producing blocked isocyanate compound and method for producing isocyanate compound 旭化成株式会社 2024-07-23 CN disclosed
WO-2023250315-A1 ASPHALT ADDITIVES WITH MULTIPLE AMINES ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) 2023-12-28 WO disclosed
US-20230407094-A1 ASPHALT ADDITIVES WITH MULTIPLE AMINES ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) 2023-12-21 US disclosed
CN-114585673-B Asphalt additive 奥升德功能材料运营有限公司 2023-11-14 CN disclosed
EP-4225841-A1 ASPHALT ADDITIVES Ascend Performance Materials Operations LLC (US) 2023-08-16 EP disclosed
WO-2023106377-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND 旭化成株式会社 2023-06-15 WO disclosed
CN-114585673-A Asphalt additive 奥升德功能材料运营有限公司 2022-06-03 CN disclosed
US-20220112129-A1 ASPHALT ADDITIVES ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) 2022-04-14 US disclosed
WO-2022076149-A1 ASPHALT ADDITIVES ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) 2022-04-14 WO disclosed
US-7186777-B2 Polyurethane compositions for golf balls ACUSHNET COMPANY (US) 2007-03-06 US disclosed
US-20040229995-A1 Polyurethane compositions for golf balls JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-18 US disclosed