SCHEMBL15052004

SCHEMBL15052004

CCOC(=O)c1cnn(Cc2cc(Br)ccc2OCC(CC)CC)c1N

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.53
▸ NPC1 O15118 5/20 0.52
▸ LMNA P02545 3/20 0.52
▸ RAB9A P51151 4/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ HPGD P15428 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ TSHR P16473 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ MAPT P10636 5/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ PTGER1 P34995 2/20 0.39
▸ CYP2C19 P33261 1/20 0.38
▸ RECQL P46063 1/20 0.38

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
SCHEMBL15051955 0.89 PTGER1 (0.43) ALDH1A1TP53MAPTCYP1A2PTGER1
SCHEMBL19610448 0.83 PTGER1 (0.40) TP53MAPTCYP1A2PTGER1
SCHEMBL15051821 0.83 PTGER1 (0.40) SMN1; SMN2KMT2ACYP1A2PTGER1
SCHEMBL15052055 0.82 PTGER1 (0.46) CYP1A2PTGER1
SCHEMBL15051959 0.82 PTGER1 (0.39) CYP1A2PTGER1
SCHEMBL15070182 0.80 PTGER1 (0.56) CYP1A2PTGER1
SCHEMBL15052433 0.80 PTGER1 (0.43) CYP1A2PTGER1
SCHEMBL15052629 0.79 SMN1; SMN2 (0.58) ALDH1A1NPC1LMNARAB9ASMN1; SMN2
SCHEMBL19610436 0.78 PTGER1 (0.43) CYP1A2PTGER1
SCHEMBL15068508 0.78 PTGER1 (0.36) LMNARAB9AKDM4ETP53SMN1; SMN2

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
EP-2797893-B1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN INC (US) 2017-11-22 — — EP disclosed
EP-2797893-B1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN INC (US) 2017-11-22 — — EP disclosed
US-9035071-B2 Compounds acting at multiple prostaglandin receptors giving a general anti-inflammatory response ALLERGAN, INC. (US) 2015-05-19 — — US disclosed
US-9035071-B2 Compounds acting at multiple prostaglandin receptors giving a general anti-inflammatory response ALLERGAN, INC. (US) 2015-05-19 — — US disclosed
US-9035071-B2 Compounds acting at multiple prostaglandin receptors giving a general anti-inflammatory response ALLERGAN, INC. (US) 2015-05-19 — — US disclosed
WO-2013101598-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN, INC. (US) 2013-07-04 — — WO disclosed
US-20130165666-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN, INC. (US) 2013-06-27 — — US disclosed
US-20130165666-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN, INC. (US) 2013-06-27 — — US disclosed
US-20130165666-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN, INC. (US) 2013-06-27 — — 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 (1 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-20130165666-A1 COMPOUNDS ACTING AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE PTGER1, PTGER4, PTGER2 ALDH1A1 2035/4885NPC1 3185/4885LMNA 4064/4885

“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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