SCHEMBL15375812

SCHEMBL15375812

CCOC(=O)c1cc(-c2ccccc2)n(CCCN2CCOCC2)c1C

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 12/20 0.70
▸ KMT2A Q03164 2/20 0.68
▸ MEN1 O00255 1/20 0.68
▸ GLA P06280 1/20 0.68
▸ ALDH1A1 P00352 2/20 0.67
▸ MAPK1 P28482 1/20 0.67
▸ TDP1 Q9NUW8 1/20 0.67
▸ MAPT P10636 1/20 0.67
▸ POLB P06746 1/20 0.66
▸ NPSR1 Q6W5P4 1/20 0.64
▸ HPGD P15428 1/20 0.60
▸ TSHR P16473 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60

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
SCHEMBL15441442 0.95 NPSR1 (0.68) TRPV4KMT2AMEN1GLAALDH1A1
SCHEMBL1066093 0.88 TRPV4 (0.77) TRPV4KMT2AALDH1A1MAPK1TDP1
SCHEMBL6455655 0.86 TRPV4 (0.74) TRPV4KMT2AALDH1A1MAPK1TDP1
SCHEMBL15441180 0.82 TRPV4 (1.00) TRPV4KMT2AALDH1A1MAPK1TDP1
SCHEMBL15441703 0.82 TRPV4 (0.68) TRPV4KMT2AALDH1A1MAPK1TDP1
SCHEMBL15386140 0.81 TRPV4 (0.62) TRPV4KMT2AALDH1A1MAPK1TDP1
SCHEMBL15386144 0.81 TRPV4 (0.59) TRPV4KMT2AMEN1GLAALDH1A1
SCHEMBL15441297 0.80 MAPK1 (1.00) TRPV4KMT2AALDH1A1MAPK1TDP1
SCHEMBL15441639 0.80 ALDH1A1 (1.00) TRPV4KMT2AALDH1A1MAPK1TDP1
SCHEMBL15441642 0.80 TRPV4 (0.58) TRPV4KMT2AMEN1GLAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170065602-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF THE UNIVERSITY OF UTAH 2017-03-09 — — US disclosed
US-20170065602-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF THE UNIVERSITY OF UTAH 2017-03-09 — — US disclosed
US-20170065602-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF THE UNIVERSITY OF UTAH 2017-03-09 — — US disclosed
US-20150133411-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-14 — — US disclosed
US-20150133411-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-14 — — US disclosed
US-20150133411-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-14 — — US disclosed
US-20130303539-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-11-14 — — US disclosed
US-20130303539-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-11-14 — — US disclosed
US-20130303539-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-11-14 — — 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 (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-20150133411-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF TRPV4, TRPV3, TRPV5 TRPV4 1/4885KMT2A 3099/4885MEN1 3646/4885
US-20130303539-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF TRPV4, TRPV3, TRPV2 TRPV4 1/4885KMT2A 4684/4885MEN1 4076/4885
US-20170065602-A1 COMPOUNDS WITH TRPV4 ACTIVITY, COMPOSITIONS AND ASSOCIATED METHODS THEREOF TRPV4, TRPV3, TRPV2 TRPV4 1/4885KMT2A 4684/4885MEN1 4076/4885

“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.

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