SCHEMBL4931440

SCHEMBL4931440

O=C(c1ccccc1)N1CCC[C@H]1CO

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.64
POLB P06746 3/20 0.59
L3MBTL1 Q9Y468 2/20 0.56
PDK2 Q15119 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
HCRTR1 O43613 2/20 0.50
HCRTR2 O43614 2/20 0.50
RIPK1 Q13546 1/20 0.50
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
CHRM2 P08172 2/20 0.48
CHRM4 P08173 2/20 0.48
CHRM1 P11229 2/20 0.48
CHRM3 P20309 2/20 0.48
ROCK2 O75116 1/20 0.47
VNN1 O95497 1/20 0.47

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
SCHEMBL11447207 1.00 SPHK2 (0.64) SPHK2POLBL3MBTL1PDK2MEN1
SCHEMBL17600738 0.95 SPHK2 (0.59) SPHK2POLBL3MBTL1PDK2MEN1
SCHEMBL17600741 0.95 SPHK2 (0.59) SPHK2POLBL3MBTL1PDK2MEN1
SCHEMBL8341295 0.91 SPHK2 (0.62) SPHK2POLBL3MBTL1PDK2MEN1
SCHEMBL8243019 0.86 NPC1 (0.54) SPHK2L3MBTL1MEN1KMT2ARAB9A
SCHEMBL4932563 0.86 SPHK2 (0.50) SPHK2POLBL3MBTL1PDK2HCRTR1
SCHEMBL8253035 0.86 NPC1 (0.54) SPHK2L3MBTL1MEN1KMT2ARAB9A
SCHEMBL8253033 0.86 NPC1 (0.54) SPHK2L3MBTL1MEN1KMT2ARAB9A
SCHEMBL5024926 0.86 SPHK2 (0.50) SPHK2POLBL3MBTL1HCRTR1HCRTR2
SCHEMBL8633642 0.86 HCRTR1 (0.53) SPHK2POLBL3MBTL1PDK2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11053195-B2 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2021-07-06 US disclosed
US-11053195-B2 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2021-07-06 US disclosed
EP-2970196-B1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS INC (US) 2020-11-25 EP disclosed
CN-108404979-B Thiourea-proline chiral catalyst and synthesis method and application thereof 郑州轻工业学院 2020-07-17 CN disclosed
US-10450269-B1 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2019-10-22 US disclosed
US-10450269-B1 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2019-10-22 US disclosed
US-20190300477-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2019-10-03 US disclosed
US-20190202782-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2019-07-04 US disclosed
US-20190202782-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2019-07-04 US disclosed
US-20190010121-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOBLOGIN GLOBAL BLOOD THERAPEUTICS, INC. 2019-01-10 US disclosed
EP-0965585-A1 Anti-amnesic thiazolidine derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1999-12-22 EP disclosed
EP-0537802-B1 N-acylpyrrolidines, process for their preparation and their use for prevention and/or treatment of amnesia ONO PHARMACEUTICAL CO (JP) 1999-08-25 EP disclosed
US-5545657-A 1-ALKYLOYLPYRROLIDIN-2-YLOXOALKANOIC ACIDS AND DERIVATIVES; ANTIAMNESIA AGENTS; INHIBITORS OF PROLYL ENDOPEPTIDASE; SUPPRESSION OF NEUROTRANSMITTER METABOLISM ONO PHARMACEUTICAL CO., LTD. (JP) 1996-08-13 US disclosed
US-5411974-A Thiazoline derivatives, treatment of amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
US-5401760-A Thiazoline derivative for treating amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1995-03-28 US disclosed
EP-0345428-B1 Anti-amnesic pyrrolidine derivatives ONO PHARMACEUTICAL CO (JP) 1995-01-18 EP disclosed
US-5212191-A Thiazoline derivatives for treatment of amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-18 US disclosed
EP-0537802-A2 N-acylpyrrolidines and N-acylthiazolidines, process for their preparation and their use for prevention and/or treatment of amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1993-04-21 EP disclosed
US-5053414-A Thiazolidine derivatives, enzyme inhibitors; amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1991-10-01 US disclosed
EP-0345428-A1 Anti-amnesic pyrrolidine derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1989-12-13 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 (5 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-10450269-B1 Compounds and uses thereof for the modulation of hemoglobin HBG2, HBG1, HBB SPHK2 974/4885POLB 3375/4885L3MBTL1 3065/4885
US-11053195-B2 Compounds and uses thereof for the modulation of hemoglobin HBG2, HBG1, HBB SPHK2 977/4885POLB 3494/4885L3MBTL1 2996/4885
US-20190300477-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB SPHK2 974/4885POLB 3375/4885L3MBTL1 3065/4885
US-20190202782-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB SPHK2 977/4885POLB 3494/4885L3MBTL1 2996/4885
US-20190010121-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOBLOGIN HBG2, HBG1, HBB SPHK2 987/4885POLB 3832/4885L3MBTL1 2138/4885

“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.