Formic Acid

Formic Acid

SCHEMBL7095598

COc1cccc(CCNC(=O)N2CCC(Nc3ccc(CCN)cc3)CC2)c1.O=CO

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
TPSAB1 Q15661 1/20 0.49
TPSD1 Q9BZJ3 1/20 0.49
TPSG1 Q9NRR2 1/20 0.49
ADRB3 P13945 6/20 0.49
ADRB1 P08588 4/20 0.46
CNR1 P21554 1/20 0.46
FAAH O00519 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
TAAR1 Q96RJ0 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL7092875 0.89 ALDH1A1 (0.56) ALDH1A1LMNAADRB3ADRB1CNR1
SCHEMBL7096580 0.88 PKM (0.53) LMNAADRB3ADRB1FAAHSIGMAR1
SCHEMBL7094171 0.87 ALDH1A1 (0.50) ALDH1A1LMNAADRB3ADRB1CNR1
SCHEMBL7092308 0.84 ALDH1A1 (0.47) ALDH1A1LMNATPSAB1TPSD1TPSG1
Formic Acid SCHEMBL7096055 0.84 TPSAB1 (0.54) TPSAB1TPSD1TPSG1ADRB3ADRB1
SCHEMBL7092879 0.84 PKM (0.53) ALDH1A1LMNAADRB3ADRB1FAAH
SCHEMBL7097083 0.82 TPSAB1 (0.53) ALDH1A1TPSAB1TPSD1TPSG1ADRB3
Formic Acid SCHEMBL7095380 0.82 TPSAB1 (0.57) TPSAB1TPSD1TPSG1ADRB3ADRB1
Formic Acid SCHEMBL7096290 0.81 TPSAB1 (0.50) TPSAB1TPSD1TPSG1ADRB3ADRB1
Formic Acid SCHEMBL7095994 0.80 ADRB3 (0.46) TPSAB1TPSD1TPSG1ADRB3ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605618-B2 Antidiabetic agents; hypoglycemic agents; anticholesterol agents; side effect reduction WYETH 2003-08-12 US disclosed
US-20030018045-A1 Heterocyclic beta-3 adrenergic receptor agonists WYETH (US) 2003-01-23 US disclosed
US-6451814-B1 SUBSTITUTED 4-((4-AMINO-5-HYDROXYPHENYL)-OXY-)PIPERIDINE ANALOGS; METABOLIC DISORDERS; ANTIDIABETIC AGENTS; ATHERO-SCLEROSIS, GASTROINTESTINAL DISORDERS, GLAUCOMA, NEUROGENETIC INFLAMMATION, OCULAR HYPERTENSION AND FREQUENT URINATION WYETH 2002-09-17 US disclosed
US-20020028832-A1 Heterocyclic beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-03-07 US disclosed
WO-2002006229-A2 HETEROCYCLIC BETA-3 ADRENERGIC RECEPTOR AGONISTS WYETH (US) 2002-01-24 WO 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 (2 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-20030018045-A1 Heterocyclic beta-3 adrenergic receptor agonists ADRB2, ADRB1, ADRB3 ALDH1A1 725/4885LMNA 2367/4885TPSAB1 596/4885
US-20020028832-A1 Heterocyclic beta-3 adrenergic receptor agonists ADRB1, ADRB3, ADRB2 ALDH1A1 524/4885LMNA 1884/4885TPSAB1 518/4885

“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.