SCHEMBL2139147

SCHEMBL2139147

Fc1ccc2oc(-c3ccccc3)nc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.66
NPC1 O15118 7/20 0.66
KDM4E B2RXH2 7/20 0.66
SMN1; SMN2 Q16637 6/20 0.66
HPGD P15428 5/20 0.66
CASP3 P42574 2/20 0.66
SENP7 Q9BQF6 2/20 0.66
SENP6 Q9GZR1 2/20 0.66
POLB P06746 2/20 0.66
SENP8 Q96LD8 1/20 0.66
PTPN1 P18031 6/20 0.60
PTPN5 P54829 6/20 0.60
PTPN2 P17706 5/20 0.60
UTRN P46939 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
ALDH1A1 P00352 5/20 0.54
MAPT P10636 4/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
CYP1A2 P05177 1/20 0.52

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
SCHEMBL30943188 1.00 RAB9A (0.66) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL28028562 0.86 SMN1; SMN2 (0.57) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL13528498 0.84 NPC1 (0.72) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL24454868 0.83 RAB9A (0.76) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL30486931 0.83 RAB9A (0.76) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL6681353 0.83 NPC1 (0.70) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL7905531 0.82 SMN1; SMN2 (0.70) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL2244575 0.82 SMN1; SMN2 (0.70) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL13254495 0.82 KDM4E (0.59) RAB9ANPC1KDM4ESMN1; SMN2HPGD
SCHEMBL9018554 0.81 NPC1 (0.68) RAB9ANPC1KDM4ESMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109232658-B Chiral rhodium complex and preparation and application thereof 中国科学院福建物质结构研究所 2020-10-27 CN claimed
CN-115739190-B Metal complex catalyst for phytic acid and preparation method and application thereof 江南大学 2024-02-13 CN disclosed
CN-115739190-A Phytic acid metal complex catalyst and preparation method and application thereof 江南大学 2023-03-07 CN disclosed
CN-112654608-A Condensed ring compounds having urea structure 桑福德伯纳姆普利斯医学发现研究所 2021-04-13 CN disclosed
CN-109232658-B Chiral rhodium complex and preparation and application thereof 中国科学院福建物质结构研究所 2020-10-27 CN disclosed
US-8242278-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 US disclosed
US-20120101278-A1 PROCESS FOR PRODUCING BIARYL COMPOUND HAGIYA KOJI (JP) 2012-04-26 US disclosed
EP-1473286-B1 PROCESS FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL CO (JP) 2009-11-04 EP disclosed
US-20090216017-A1 PROCESS FOR PRODUCING BIARYL COMPOUND HAGIYA KOJI 2009-08-27 US disclosed
US-7554000-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-30 US disclosed
US-20050096471-A1 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-05-05 US disclosed
EP-1473286-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2004-11-03 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120101278-A1 PROCESS FOR PRODUCING BIARYL COMPOUND PPOX, CAT, TYR RAB9A 2254/4885NPC1 4102/4885KDM4E 3428/4885
US-20090216017-A1 PROCESS FOR PRODUCING BIARYL COMPOUND PPOX, CAT, TYR RAB9A 2254/4885NPC1 4102/4885KDM4E 3428/4885
US-20050096471-A1 Process for producing biaryl compound PPOX, CAT, TYR RAB9A 2254/4885NPC1 4102/4885KDM4E 3428/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.