SCHEMBL2221665

SCHEMBL2221665

C=CCN(CC=C)c1ccc(N)cc1N

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 2/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34
MAPK1 P28482 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
PRKCI P41743 1/20 0.31
TP53 P04637 2/20 0.30
ACHE P22303 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30
CASP7 P55210 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL29499603 1.00 CASP1 (0.34) CASP1ALDH1A1MAPTMAPK1SMN1; SMN2
Ammonia Solution, Strong SCHEMBL5991120 0.98 CASP1 (0.33) CASP1ALDH1A1MAPTMAPK1SMN1; SMN2
SCHEMBL9999846 0.90 ALDH1A1 (0.40) CASP1ALDH1A1MAPTMAPK1PRKCI
SCHEMBL2786924 0.85 PRKCI (0.31) CASP1PRKCIACHE
SCHEMBL29353254 0.85 PRKCI (0.31) CASP1PRKCIACHE
Ammonia Solution, Strong SCHEMBL5992940 0.83 PRKCI (0.30) PRKCI
SCHEMBL10626050 0.81 KMT2A (0.50) ALDH1A1MAPTMAPK1SMN1; SMN2LMNA
SCHEMBL8524523 0.81 ADRA2B (0.31) ALDH1A1MAPTMAPK1SMN1; SMN2LMNA
SCHEMBL17047653 0.81 PYCR1 (0.39) ALDH1A1MAPTMAPK1SMN1; SMN2LMNA
SCHEMBL26135328 0.80 CASP1 (0.31) CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385823-B1 GUANIDINO COMPOUNDS AS MELANOCORTIN-4 RECEPTOR (MC4-R) AGONISTS CHIRON CORP (US) 2006-12-13 EP claimed
US-20250257265-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT NISSAN CHEMICAL CORPORATION (JP) 2025-08-14 US disclosed
WO-2025127092-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2025-06-19 WO disclosed
WO-2025121249-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2025-06-12 WO disclosed
WO-2025121189-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2025-06-12 WO disclosed
WO-2025105279-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2025-05-22 WO disclosed
WO-2025105278-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2025-05-22 WO disclosed
US-20250145888-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT NISSAN CHEMICAL CORPORATION (JP) 2025-05-08 US disclosed
WO-2025089307-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2025-05-01 WO disclosed
WO-2025079519-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2025-04-17 WO disclosed
US-20010039361-A1 Materials for inducing alignment in liquid crystal and liquid crystal displays GIBBONS WAYNE M (US) 2001-11-08 US disclosed
US-6313348-B1 LIQUID CRYSTAL GIBBONS WAYNE M (US) 2001-11-06 US disclosed
US-20010018099-A1 Materials for inducing alignment in liquid crystals and liquid crystal displays ELSICON, INC. 2001-08-30 US disclosed
US-6268460-B1 POLYIMIDES, POLYAMIC ACID AND ESTER COPOLYMERS GIBBONS WAYNE M (US) 2001-07-31 US disclosed
US-6242061-B1 POLYAMIC ACIDS, POLYIMIDES ELSICON INC. 2001-06-05 US disclosed
WO-2001030938-A1 MATERIALS FOR INDUCING ALIGNMENT IN LIQUID CRYSTALS AND LIQUID CRYSTAL DISPLAYS ELSICON, INC. (US) 2001-05-03 WO disclosed
US-6194039-B1 POLYIMIDES, POLYAMIC ACIDS ELSICON, INC. 2001-02-27 US disclosed
US-6143380-A POLYIMIDES ELSICON INC. (US) 2000-11-07 US disclosed
US-6103322-A POLYAMIC ACID ELSICON INC. (US) 2000-08-15 US disclosed
WO-2000039633-A1 MATERIALS FOR INDUCING ALIGNMENT OF LIQUID CRYSTALS AND LIQUID CRYSTAL OPTICAL ELEMENTS ELSICON, INC. (US) 2000-07-06 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 (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-20010039361-A1 Materials for inducing alignment in liquid crystal and liquid crystal displays DYNC1LI1, DYNC1LI2, DYNLL1 CASP1 866/4885ALDH1A1 1492/4885MAPT 1644/4885

“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.