SCHEMBL557084

SCHEMBL557084

Clc1ccc2ccc3ccc(Cl)nc3c2n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.43
CCR5 P51681 2/20 0.43
RAB9A P51151 1/20 0.43
SLC40A1 Q9NP59 3/20 0.40
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
PTGER4 P35408 1/20 0.35
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GMNN O75496 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
HSP90AA1 P07900 1/20 0.35
MMP2 P08253 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
MMP9 P14780 1/20 0.35
ALOX15 P16050 1/20 0.35
NFKB1 P19838 1/20 0.35

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
SCHEMBL29533844 1.00 CCR1 (0.43) CCR1CCR5RAB9ASLC40A1CRHBP
SCHEMBL12446257 0.84 SLC40A1 (0.34) CCR1CCR5RAB9ASLC40A1CRHBP
SCHEMBL12446258 0.84 CCR1 (0.71) CCR1CCR5RAB9ASLC40A1KDM4E
SCHEMBL11366801 0.83 SLC40A1 (0.37) CCR1CCR5RAB9ASLC40A1CYP3A4
SCHEMBL16511929 0.79 MTNR1A (0.41) CCR1CCR5RAB9AHTTTDP1
Water SCHEMBL8090024 0.79 CCR1 (0.67) CCR1CCR5CYP3A4TSHRKDM4E
SCHEMBL29683992 0.79 SLC40A1 (0.45) CCR1CCR5SLC40A1CYP3A4TSHR
SCHEMBL845037 0.79 SLC40A1 (0.45) CCR1CCR5SLC40A1CYP3A4TSHR
SCHEMBL17782979 0.78 PARP1 (0.47) RAB9ASLC40A1CYP3A4KDM4EHSP90AA1
SCHEMBL24716239 0.77 LMNA (0.38) CCR1CCR5SLC40A1CYP3A4TSHR

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 217 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326892-A1 TRIPTYCENE-PHENANTHROLINE BASED MICROPOROUS POLYMER FOR CO2 CAPTURE OVER CH4 AND N2 KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2025-10-23 US claimed
CN-117843694-A Hydroxy phenanthroline binuclear cobalt complex and preparation method and application thereof 云南师范大学 2024-04-09 CN claimed
CN-117460260-A Stable and dynamically adjustable mechanical interlocking molecular device and preparation and control methods and application thereof 浙江大学杭州国际科创中心 2024-01-26 CN claimed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
CN-107586296-B Preparation method and application of 2, 9-diaryl substituted phenanthroline and iron complex thereof 南开大学 2023-05-02 CN claimed
CN-116037211-A Cobalt-based complex catalyst and preparation method and application thereof 合肥工业大学 2023-05-02 CN claimed
CN-115974732-A Method for preparing alkyl sulfonyl fluoride 中国石油大学(华东) 2023-04-18 CN claimed
CN-113549064-B Two 1, 10-phenanthroline skeleton ligands and iron complex thereof, and preparation method and application thereof 南开大学 2022-11-18 CN claimed
CN-113549064-A Two 1, 10-phenanthroline skeleton ligands and iron complex thereof, and preparation method and application thereof 南开大学 2021-10-26 CN claimed
CN-111718381-A Osmium metal organic compound containing polypyridine ligand and preparation method and application thereof 荆楚理工学院 2020-09-29 CN claimed
CN-111518145-A Cyanide-bridged metal organic compound with intramolecular magnetic transformation, and preparation method and application thereof 荆楚理工学院 2020-08-11 CN claimed
CN-110028504-A The preparation method and applications of phenanthroline and its cobalt complex that 2,9- diaryl replaces 南开大学 2019-07-19 CN claimed
CN-107586296-A The preparation method and applications of the phenanthroline and its iron complex of the substitution of 2,9 diaryl 南开大学 2018-01-16 CN claimed
EP-0853064-B1 Process for the synthesis of hydrogen peroxide ENICHEM SPA (IT) 2000-02-23 EP claimed
EP-0808796-B1 Process for the preparation of hydrogen peroxide ENICHEM SPA (IT) 2000-02-09 EP claimed
EP-0894783-A1 Process for the synthesis of phenol from benzene Enichem S.p.A. (IT) 1999-02-03 EP claimed
US-5783164-A PALLADIUM CATALYST WITH A NITROGENATED LIGAND STABLE TO OXIDATION ENICHEM S.P.A. (IT) 1998-07-21 US claimed
EP-0853064-A1 Process for the synthesis of hydrogen peroxide ENICHEM S.p.A. (IT) 1998-07-15 EP claimed
EP-0808796-A1 Process for the preparation of hydrogen peroxide ENICHEM S.p.A. (IT) 1997-11-26 EP claimed
US-4777261-A Preparation of 2-benzoxazolones SHELL OIL COMPANY (US) 1988-10-11 US claimed