SCHEMBL6750366

SCHEMBL6750366

COP(=O)(CC(=O)CCc1cccs1)OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
BRD4 O60885 1/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
NPC1 O15118 5/20 0.42
RAB9A P51151 4/20 0.42
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TRPM8 Q7Z2W7 1/20 0.40
MAPT P10636 1/20 0.39
TAAR1 Q96RJ0 2/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.39
CYP2C19 P33261 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
HPGD P15428 2/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 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
SCHEMBL4994046 0.85 SMN1; SMN2 (0.48) POLBSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL8425406 0.81 POLB (0.47) POLBTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL11379564 0.80 KMT2A (0.40) POLBBRD4SMN1; SMN2NPC1RAB9A
SCHEMBL7332254 0.79 TAAR1 (0.54) POLBTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL4461404 0.76 SMN1; SMN2 (0.51) POLBTDP1BRD4SMN1; SMN2NPC1
SCHEMBL12530774 0.76 POLB (0.47) POLBTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL187684 0.75 ALOX5 (0.51) POLBTDP1NPC1RAB9AALDH1A1
SCHEMBL11550988 0.75 POLB (0.44) POLBTDP1SMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL8763040 0.74 SMN1; SMN2 (0.50) POLBTDP1BRD4SMN1; SMN2NPC1
SCHEMBL6748905 0.74 CYP2A6 (0.44) RAB9AGAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040044045-A1 Cyclopentane heptan(ene)oic acid, 2-heteroarylalkenyl derivatives as therapeutic agents ALLERGAN, INC. 2004-03-04 US disclosed
US-6602900-B2 F-type prostaglandins as ocular hypotensives ALLERGAN, INC. 2003-08-05 US disclosed
US-20020198249-A1 Cyclopentane heptan(ENE)oic acid, 2-heteroarylalkenyl derivatives as therapeutic agents ALLERGAN SALES, INC. 2002-12-26 US disclosed
US-6310087-B2 TREATING GASTRIC OR DUODENAL ULCER, OSTEOPOROSIS, CONSTIPATION, RENAL DISORDERS, SEXUAL DYSFUNCTION, BALDNESS, DIABETES, CANCER AND DISORDER OF IMMUNE REGULATION ALLERGAN SALES, INC. 2001-10-30 US disclosed
US-20010016597-A1 Cyclopentane heptan(ene)oic acid, 2-heteroarylalkenyl derivatives as therapeutic agents ALLERGAN SALES, INC. 2001-08-23 US disclosed
EP-0825980-B1 CYCLOPENTANE HEPTAN(ENE)OIC ACID, 2-HETEROARYLAKENYL DERIVATIVES AS THERAPEUTIC AGENTS FOR THE TREATMENT OF OCULAR HYPERTENSION ALLERGAN SALES INC (US) 2001-07-04 EP disclosed
US-6204287-B1 TREATING VISION DEFECTS ALLERGAN SALES, INC. 2001-03-20 US disclosed
US-6037364-A ADMINISTERING OCULAR HYPOTENSIVE AGENT; TREATING CARDIOVASCULAR DISORDERS; ANTICOAGULANTS ALLERGAN SALES, INC. (US) 2000-03-14 US disclosed
US-5834498-A OCULAR HYPOTENSIVE AGENTS ALLERGAN (US) 1998-11-10 US disclosed
EP-0825980-A1 CYCLOPENTANE HEPTAN(ENE)OIC ACID, 2-HETEROARYLAKENYL DERIVATIVES AS THERAPEUTIC AGENTS FOR THE TREATMENT OF OCULAR HYPERTENSION Allergan (US) 1998-03-04 EP disclosed
WO-1996036599-A1 CYCLOPENTANE HEPTAN(ENE)OIC ACID, 2-HETEROARYLALKENYL DERIVATIVES AS THERAPEUTIC AGENTS FOR THE TREATMENT OF OCULAR HYPERTENSION ALLERGAN (US) 1996-11-21 WO disclosed
US-4143051-A GREATER TISSUE SPECIFICITY OF ACTION PFIZER INC. (US) 1979-03-06 US disclosed
US-4113723-A TISSUE SPECIFICITY PFIZER INC. (US) 1978-09-12 US disclosed
US-4102894-A TISSUE SPECIFICITY PFIZER INC. (US) 1978-07-25 US disclosed
US-4080368-A PROSTAGLANDINS PFIZER INC. (US) 1978-03-21 US disclosed
US-3980642-A 15-Substitute D-ω-pentanorprostaglandins PFIZER INC. (US) 1976-09-14 US disclosed
US-3956284-A INCREASED TISSUE SPECIFITY OF ACTION PFIZER INC. (US) 1976-05-11 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-20040044045-A1 Cyclopentane heptan(ene)oic acid, 2-heteroarylalkenyl derivatives as therapeutic agents PTGER1, PTGFR, PTGER2 POLB 1918/4885TDP1 4328/4885BRD4 4492/4885
US-20010016597-A1 Cyclopentane heptan(ene)oic acid, 2-heteroarylalkenyl derivatives as therapeutic agents PTGER1, PTGER2, PTGFR POLB 1745/4885TDP1 4200/4885BRD4 4518/4885
US-20020198249-A1 Cyclopentane heptan(ENE)oic acid, 2-heteroarylalkenyl derivatives as therapeutic agents PTGER1, PTGFR, PTGER2 POLB 1897/4885TDP1 4342/4885BRD4 4485/4885

“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.