SCHEMBL15426435

SCHEMBL15426435

O=S(=O)(c1ccc(C(F)(F)F)cc1)N1CCOC12CCNCC2

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
ALDH1A1 P00352 2/20 0.53
HCRTR1 O43613 2/20 0.43
HCRTR2 O43614 2/20 0.43
HTR6 P50406 2/20 0.41
EPHX2 P34913 1/20 0.40
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
MMP14 P50281 1/20 0.40

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
SCHEMBL12655986 0.86 L3MBTL1 (0.54) L3MBTL1ALDH1A1HCRTR1HCRTR2EPHX2
SCHEMBL12627182 0.86 L3MBTL1 (0.56) L3MBTL1ALDH1A1HCRTR1HCRTR2
SCHEMBL12623940 0.84 L3MBTL1 (0.50) L3MBTL1ALDH1A1HCRTR1HCRTR2MMP3
SCHEMBL12623976 0.83 ALDH1A1 (0.49) L3MBTL1ALDH1A1HCRTR1HCRTR2
SCHEMBL12673214 0.83 L3MBTL1 (0.56) L3MBTL1ALDH1A1HCRTR1HCRTR2
SCHEMBL12624222 0.83 L3MBTL1 (0.56) L3MBTL1ALDH1A1HCRTR1HCRTR2
SCHEMBL12623988 0.83 L3MBTL1 (0.56) L3MBTL1ALDH1A1HCRTR1HCRTR2
SCHEMBL22381075 0.82 L3MBTL1 (0.48) L3MBTL1ALDH1A1HCRTR1HCRTR2HTR6
SCHEMBL12626029 0.81 ALDH1A1 (0.60) L3MBTL1ALDH1A1
SCHEMBL12621982 0.81 ALDH1A1 (0.60) L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11385221-B2 Alzheimer's disease assay in a living patient PAIN THERAPEUTICS, INC. (US) 2022-07-12 US disclosed
US-20210389298-A1 Alzheimer's Disease Assay in a Living Patient PAIN THERAPEUTICS, INC. (US) 2021-12-16 US disclosed
EP-3791875-A1 METHOD FOR INHIBITING GROWTH OF CANCER CELLS Pain Therapeutics, Inc. (US) 2021-03-17 EP disclosed
US-10760052-B2 Method of inhibiting tau phosphorylation Cassava Science, Inc. (US) 2020-09-01 US disclosed
US-20190271686-A1 ALZHEIMER'S DISEASE ASSAY IN A LIVING PATIENT PAIN THERAPEUTICS, INC. 2019-09-05 US disclosed
US-10363239-B2 Method for inhibiting growth of cancer cells PAIN THERAPEUTICS (US) 2019-07-30 US disclosed
US-20190136184-A1 METHOD OF INHIBITING TAU PHOSPHORYLATION CASSAVA SCIENCES, INC. 2019-05-09 US disclosed
US-10222368-B2 Alzheimer's disease assay in a living patient PAIN THERAPEUTICS, INC. (US) 2019-03-05 US disclosed
EP-2882428-B1 A METHOD OF INHIBITING TAU PHOSPHORYLATION PAIN THERAPEUTICS INC (US) 2019-01-16 EP disclosed
EP-2872899-B1 ALZHEIMER'S DISEASE ASSAY IN A LIVING PATIENT PAIN THERAPEUTICS INC (US) 2018-07-11 EP disclosed
US-9433604-B2 Method for inhibiting growth of cancer cells PAIN THERAPEUTICS INC. (US) 2016-09-06 US disclosed
US-9354223-B2 Alzheimer's disease assay in a living patient PAIN THERAPEUTICS INC. (US) 2016-05-31 US disclosed
US-9354223-B2 Alzheimer's disease assay in a living patient PAIN THERAPEUTICS INC. (US) 2016-05-31 US disclosed
US-20150148318-A1 METHOD FOR INHIBITING GROWTH OF CANCER CELLS PAIN THERAPEUTICS, INC. 2015-05-28 US disclosed
US-20150148318-A1 METHOD FOR INHIBITING GROWTH OF CANCER CELLS PAIN THERAPEUTICS, INC. 2015-05-28 US disclosed
WO-2015054027-A1 METHOD FOR INHIBITING GROWTH OF CANCER CELLS PAIN THERAPEUTICS, INC. (US) 2015-04-16 WO disclosed
US-20140017699-A1 ALZHEIMER'S DISEASE ASSAY IN A LIVING PATIENT CASSAVA SCIENCES, INC. 2014-01-16 US disclosed
US-20140017698-A1 ALZHEIMER'S DISEASE ASSAY IN A LIVING PATIENT WANG HOAU-YAN (US) 2014-01-16 US disclosed
US-20140017699-A1 ALZHEIMER'S DISEASE ASSAY IN A LIVING PATIENT CASSAVA SCIENCES, INC. 2014-01-16 US disclosed
US-20140017698-A1 ALZHEIMER'S DISEASE ASSAY IN A LIVING PATIENT WANG HOAU-YAN (US) 2014-01-16 US 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 (4 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-10363239-B2 Method for inhibiting growth of cancer cells FLNA, FLNB, FSCN1 L3MBTL1 1041/4885ALDH1A1 3552/4885HCRTR1 3430/4885
US-20190136184-A1 METHOD OF INHIBITING TAU PHOSPHORYLATION FLNA, FLNB, MAPT L3MBTL1 1789/4885ALDH1A1 4388/4885HCRTR1 2888/4885
US-10760052-B2 Method of inhibiting tau phosphorylation FLNA, FLNB, MAPT L3MBTL1 1789/4885ALDH1A1 4388/4885HCRTR1 2888/4885
US-20150148318-A1 METHOD FOR INHIBITING GROWTH OF CANCER CELLS FLNA, FLNB, FSCN1 L3MBTL1 1041/4885ALDH1A1 3552/4885HCRTR1 3430/4885

“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.